USER MOD reduce.3.24.130724 H: found=0, std=0, add=787, rem=0, adj=14 USER MOD reduce.3.24.130724 removed 789 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 80 ASN : amide:sc= -3.92! C(o=-3.9!,f=-4.7!) USER MOD Set 1.2: A 96 MET CE :methyl -164:sc= -0.018 (180deg=-0.0791) USER MOD Set 2.1: A 71 GLN : amide:sc= 0.00948 K(o=0.46,f=-0.077) USER MOD Set 2.2: A 75 ASN : amide:sc= 0.45 K(o=0.46,f=-1.7) USER MOD Single : A 19 GLN : amide:sc= -0.0922 X(o=-0.092,f=-0.092) USER MOD Single : A 21 TYR OH : rot 180:sc= 0 USER MOD Single : A 26 ASN : amide:sc= -2.11! X(o=-2.1!,f=-2.4) USER MOD Single : A 41 SER OG : rot 72:sc= 0.169 USER MOD Single : A 51 LYS NZ :NH3+ 174:sc= 0 (180deg=-0.0367) USER MOD Single : A 53 TYR OH : rot 180:sc= 0.172 USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 MET CE :methyl 146:sc= -0.0704 (180deg=-1.2) USER MOD Single : A 60 MET CE :methyl 175:sc= -0.294 (180deg=-0.339) USER MOD Single : A 61 HIS : no HD1:sc= -0.0283 X(o=-0.028,f=0) USER MOD Single : A 62 ASN : amide:sc= -3.21! C(o=-3.2!,f=-2.3!) USER MOD Single : A 63 TYR OH : rot 180:sc= -1.09 USER MOD Single : A 67 ASN : amide:sc= -0.182 X(o=-0.18,f=0) USER MOD Single : A 68 SER OG : rot 180:sc= 0 USER MOD Single : A 70 GLN : amide:sc= -0.0872 X(o=-0.087,f=-0.087) USER MOD Single : A 72 LYS NZ :NH3+ -108:sc= -1.49 (180deg=-3.81!) USER MOD Single : A 74 SER OG : rot 180:sc= 0 USER MOD Single : A 78 HIS : no HD1:sc= -0.166 X(o=-0.17,f=-0.011) USER MOD Single : A 82 LYS NZ :NH3+ 150:sc= -0.16 (180deg=-0.818) USER MOD Single : A 85 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 90 SER OG : rot 180:sc= 0 USER MOD Single : A 98 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 101 GLN : amide:sc= -0.455 X(o=-0.45,f=0) USER MOD Single : A 102 CYS SG : rot -44:sc= -0.29 USER MOD Single : A 116 GLN : amide:sc= -0.103 K(o=-0.1,f=-2.1!) USER MOD Single : A 122 GLN : amide:sc= -2.14! C(o=-2.1!,f=-2.4!) USER MOD ----------------------------------------------------------------- ATOM 220 N GLN A 19 8.159 14.597 1.357 1.00 0.00 N ATOM 221 CA GLN A 19 9.048 13.456 1.540 1.00 0.00 C ATOM 222 C GLN A 19 8.317 12.147 1.257 1.00 0.00 C ATOM 223 O GLN A 19 8.864 11.243 0.624 1.00 0.00 O ATOM 224 CB GLN A 19 9.610 13.443 2.962 1.00 0.00 C ATOM 225 CG GLN A 19 10.337 14.723 3.341 1.00 0.00 C ATOM 226 CD GLN A 19 11.451 15.070 2.373 1.00 0.00 C ATOM 227 OE1 GLN A 19 11.445 16.138 1.760 1.00 0.00 O ATOM 228 NE2 GLN A 19 12.414 14.168 2.231 1.00 0.00 N ATOM 0 HA GLN A 19 9.872 13.552 0.833 1.00 0.00 H new ATOM 0 HB2 GLN A 19 8.794 13.277 3.665 1.00 0.00 H new ATOM 0 HB3 GLN A 19 10.295 12.602 3.065 1.00 0.00 H new ATOM 0 HG2 GLN A 19 9.622 15.545 3.376 1.00 0.00 H new ATOM 0 HG3 GLN A 19 10.752 14.618 4.344 1.00 0.00 H new ATOM 0 HE21 GLN A 19 12.378 13.296 2.759 1.00 0.00 H new ATOM 0 HE22 GLN A 19 13.190 14.346 1.593 1.00 0.00 H new ATOM 237 N LEU A 20 7.080 12.052 1.730 1.00 0.00 N ATOM 238 CA LEU A 20 6.273 10.853 1.529 1.00 0.00 C ATOM 239 C LEU A 20 5.885 10.698 0.062 1.00 0.00 C ATOM 240 O LEU A 20 5.841 9.586 -0.465 1.00 0.00 O ATOM 241 CB LEU A 20 5.016 10.908 2.398 1.00 0.00 C ATOM 242 CG LEU A 20 3.903 9.925 2.031 1.00 0.00 C ATOM 243 CD1 LEU A 20 4.353 8.494 2.279 1.00 0.00 C ATOM 244 CD2 LEU A 20 2.638 10.233 2.819 1.00 0.00 C ATOM 0 H LEU A 20 6.613 12.791 2.256 1.00 0.00 H new ATOM 0 HA LEU A 20 6.871 9.990 1.821 1.00 0.00 H new ATOM 0 HB2 LEU A 20 5.306 10.728 3.433 1.00 0.00 H new ATOM 0 HB3 LEU A 20 4.611 11.919 2.352 1.00 0.00 H new ATOM 0 HG LEU A 20 3.681 10.036 0.970 1.00 0.00 H new ATOM 0 HD11 LEU A 20 3.549 7.808 2.012 1.00 0.00 H new ATOM 0 HD12 LEU A 20 5.231 8.278 1.670 1.00 0.00 H new ATOM 0 HD13 LEU A 20 4.603 8.368 3.333 1.00 0.00 H new ATOM 0 HD21 LEU A 20 1.857 9.524 2.545 1.00 0.00 H new ATOM 0 HD22 LEU A 20 2.845 10.151 3.886 1.00 0.00 H new ATOM 0 HD23 LEU A 20 2.305 11.246 2.591 1.00 0.00 H new ATOM 256 N TYR A 21 5.607 11.820 -0.593 1.00 0.00 N ATOM 257 CA TYR A 21 5.223 11.809 -1.999 1.00 0.00 C ATOM 258 C TYR A 21 6.354 11.269 -2.869 1.00 0.00 C ATOM 259 O TYR A 21 6.123 10.499 -3.802 1.00 0.00 O ATOM 260 CB TYR A 21 4.841 13.218 -2.456 1.00 0.00 C ATOM 261 CG TYR A 21 3.377 13.541 -2.265 1.00 0.00 C ATOM 262 CD1 TYR A 21 2.858 13.780 -0.998 1.00 0.00 C ATOM 263 CD2 TYR A 21 2.511 13.606 -3.350 1.00 0.00 C ATOM 264 CE1 TYR A 21 1.520 14.075 -0.818 1.00 0.00 C ATOM 265 CE2 TYR A 21 1.173 13.901 -3.179 1.00 0.00 C ATOM 266 CZ TYR A 21 0.682 14.135 -1.911 1.00 0.00 C ATOM 267 OH TYR A 21 -0.651 14.428 -1.737 1.00 0.00 O ATOM 0 H TYR A 21 5.641 12.749 -0.172 1.00 0.00 H new ATOM 0 HA TYR A 21 4.360 11.152 -2.108 1.00 0.00 H new ATOM 0 HB2 TYR A 21 5.439 13.944 -1.905 1.00 0.00 H new ATOM 0 HB3 TYR A 21 5.094 13.330 -3.510 1.00 0.00 H new ATOM 0 HD1 TYR A 21 3.512 13.734 -0.139 1.00 0.00 H new ATOM 0 HD2 TYR A 21 2.891 13.423 -4.344 1.00 0.00 H new ATOM 0 HE1 TYR A 21 1.133 14.258 0.174 1.00 0.00 H new ATOM 0 HE2 TYR A 21 0.514 13.948 -4.033 1.00 0.00 H new ATOM 0 HH TYR A 21 -1.101 14.432 -2.607 1.00 0.00 H new ATOM 277 N LEU A 22 7.579 11.678 -2.556 1.00 0.00 N ATOM 278 CA LEU A 22 8.748 11.236 -3.308 1.00 0.00 C ATOM 279 C LEU A 22 8.895 9.719 -3.243 1.00 0.00 C ATOM 280 O LEU A 22 9.006 9.052 -4.272 1.00 0.00 O ATOM 281 CB LEU A 22 10.011 11.905 -2.764 1.00 0.00 C ATOM 282 CG LEU A 22 10.027 13.434 -2.794 1.00 0.00 C ATOM 283 CD1 LEU A 22 10.994 13.979 -1.755 1.00 0.00 C ATOM 284 CD2 LEU A 22 10.394 13.937 -4.182 1.00 0.00 C ATOM 0 H LEU A 22 7.788 12.315 -1.787 1.00 0.00 H new ATOM 0 HA LEU A 22 8.610 11.525 -4.350 1.00 0.00 H new ATOM 0 HB2 LEU A 22 10.155 11.580 -1.733 1.00 0.00 H new ATOM 0 HB3 LEU A 22 10.865 11.541 -3.335 1.00 0.00 H new ATOM 0 HG LEU A 22 9.026 13.793 -2.552 1.00 0.00 H new ATOM 0 HD11 LEU A 22 10.991 15.068 -1.792 1.00 0.00 H new ATOM 0 HD12 LEU A 22 10.686 13.649 -0.763 1.00 0.00 H new ATOM 0 HD13 LEU A 22 11.998 13.611 -1.965 1.00 0.00 H new ATOM 0 HD21 LEU A 22 10.400 15.027 -4.184 1.00 0.00 H new ATOM 0 HD22 LEU A 22 11.383 13.568 -4.453 1.00 0.00 H new ATOM 0 HD23 LEU A 22 9.662 13.577 -4.905 1.00 0.00 H new ATOM 296 N TRP A 23 8.893 9.181 -2.029 1.00 0.00 N ATOM 297 CA TRP A 23 9.024 7.742 -1.831 1.00 0.00 C ATOM 298 C TRP A 23 8.238 6.973 -2.888 1.00 0.00 C ATOM 299 O TRP A 23 8.710 5.965 -3.415 1.00 0.00 O ATOM 300 CB TRP A 23 8.539 7.352 -0.434 1.00 0.00 C ATOM 301 CG TRP A 23 8.243 5.890 -0.294 1.00 0.00 C ATOM 302 CD1 TRP A 23 9.139 4.862 -0.362 1.00 0.00 C ATOM 303 CD2 TRP A 23 6.961 5.294 -0.064 1.00 0.00 C ATOM 304 NE1 TRP A 23 8.492 3.662 -0.188 1.00 0.00 N ATOM 305 CE2 TRP A 23 7.156 3.900 -0.003 1.00 0.00 C ATOM 306 CE3 TRP A 23 5.670 5.801 0.098 1.00 0.00 C ATOM 307 CZ2 TRP A 23 6.106 3.011 0.212 1.00 0.00 C ATOM 308 CZ3 TRP A 23 4.629 4.918 0.311 1.00 0.00 C ATOM 309 CH2 TRP A 23 4.851 3.536 0.367 1.00 0.00 C ATOM 0 H TRP A 23 8.802 9.719 -1.167 1.00 0.00 H new ATOM 0 HA TRP A 23 10.078 7.482 -1.928 1.00 0.00 H new ATOM 0 HB2 TRP A 23 9.297 7.633 0.297 1.00 0.00 H new ATOM 0 HB3 TRP A 23 7.640 7.921 -0.197 1.00 0.00 H new ATOM 0 HD1 TRP A 23 10.200 4.975 -0.528 1.00 0.00 H new ATOM 0 HE1 TRP A 23 8.935 2.743 -0.195 1.00 0.00 H new ATOM 0 HE3 TRP A 23 5.488 6.865 0.057 1.00 0.00 H new ATOM 0 HZ2 TRP A 23 6.276 1.945 0.255 1.00 0.00 H new ATOM 0 HZ3 TRP A 23 3.627 5.300 0.437 1.00 0.00 H new ATOM 0 HH2 TRP A 23 4.016 2.872 0.536 1.00 0.00 H new ATOM 320 N VAL A 24 7.037 7.455 -3.193 1.00 0.00 N ATOM 321 CA VAL A 24 6.187 6.813 -4.188 1.00 0.00 C ATOM 322 C VAL A 24 6.768 6.966 -5.589 1.00 0.00 C ATOM 323 O VAL A 24 6.704 6.044 -6.403 1.00 0.00 O ATOM 324 CB VAL A 24 4.762 7.397 -4.169 1.00 0.00 C ATOM 325 CG1 VAL A 24 3.897 6.730 -5.227 1.00 0.00 C ATOM 326 CG2 VAL A 24 4.142 7.245 -2.788 1.00 0.00 C ATOM 0 H VAL A 24 6.631 8.287 -2.765 1.00 0.00 H new ATOM 0 HA VAL A 24 6.142 5.755 -3.930 1.00 0.00 H new ATOM 0 HB VAL A 24 4.821 8.461 -4.400 1.00 0.00 H new ATOM 0 HG11 VAL A 24 2.894 7.156 -5.198 1.00 0.00 H new ATOM 0 HG12 VAL A 24 4.334 6.896 -6.212 1.00 0.00 H new ATOM 0 HG13 VAL A 24 3.842 5.659 -5.030 1.00 0.00 H new ATOM 0 HG21 VAL A 24 3.135 7.663 -2.793 1.00 0.00 H new ATOM 0 HG22 VAL A 24 4.095 6.188 -2.525 1.00 0.00 H new ATOM 0 HG23 VAL A 24 4.751 7.775 -2.055 1.00 0.00 H new ATOM 336 N ASP A 25 7.336 8.135 -5.863 1.00 0.00 N ATOM 337 CA ASP A 25 7.932 8.409 -7.166 1.00 0.00 C ATOM 338 C ASP A 25 9.115 7.483 -7.428 1.00 0.00 C ATOM 339 O ASP A 25 9.262 6.942 -8.523 1.00 0.00 O ATOM 340 CB ASP A 25 8.382 9.868 -7.248 1.00 0.00 C ATOM 341 CG ASP A 25 7.247 10.804 -7.615 1.00 0.00 C ATOM 342 OD1 ASP A 25 6.258 10.332 -8.213 1.00 0.00 O ATOM 343 OD2 ASP A 25 7.349 12.009 -7.303 1.00 0.00 O ATOM 0 H ASP A 25 7.396 8.908 -5.201 1.00 0.00 H new ATOM 0 HA ASP A 25 7.176 8.227 -7.930 1.00 0.00 H new ATOM 0 HB2 ASP A 25 8.802 10.170 -6.289 1.00 0.00 H new ATOM 0 HB3 ASP A 25 9.178 9.959 -7.988 1.00 0.00 H new ATOM 348 N ASN A 26 9.958 7.307 -6.416 1.00 0.00 N ATOM 349 CA ASN A 26 11.130 6.448 -6.537 1.00 0.00 C ATOM 350 C ASN A 26 10.737 5.057 -7.026 1.00 0.00 C ATOM 351 O ASN A 26 11.313 4.538 -7.982 1.00 0.00 O ATOM 352 CB ASN A 26 11.853 6.343 -5.193 1.00 0.00 C ATOM 353 CG ASN A 26 11.909 7.670 -4.462 1.00 0.00 C ATOM 354 OD1 ASN A 26 11.860 8.734 -5.079 1.00 0.00 O ATOM 355 ND2 ASN A 26 12.013 7.613 -3.139 1.00 0.00 N ATOM 0 H ASN A 26 9.851 7.748 -5.503 1.00 0.00 H new ATOM 0 HA ASN A 26 11.802 6.895 -7.269 1.00 0.00 H new ATOM 0 HB2 ASN A 26 11.347 5.608 -4.568 1.00 0.00 H new ATOM 0 HB3 ASN A 26 12.867 5.978 -5.356 1.00 0.00 H new ATOM 0 HD21 ASN A 26 12.055 8.474 -2.593 1.00 0.00 H new ATOM 0 HD22 ASN A 26 12.050 6.709 -2.669 1.00 0.00 H new ATOM 362 N ILE A 27 9.752 4.460 -6.363 1.00 0.00 N ATOM 363 CA ILE A 27 9.281 3.130 -6.730 1.00 0.00 C ATOM 364 C ILE A 27 8.950 3.056 -8.217 1.00 0.00 C ATOM 365 O ILE A 27 8.284 3.929 -8.775 1.00 0.00 O ATOM 366 CB ILE A 27 8.035 2.730 -5.918 1.00 0.00 C ATOM 367 CG1 ILE A 27 8.362 2.700 -4.423 1.00 0.00 C ATOM 368 CG2 ILE A 27 7.514 1.377 -6.379 1.00 0.00 C ATOM 369 CD1 ILE A 27 7.179 3.028 -3.539 1.00 0.00 C ATOM 0 H ILE A 27 9.265 4.876 -5.569 1.00 0.00 H new ATOM 0 HA ILE A 27 10.090 2.435 -6.505 1.00 0.00 H new ATOM 0 HB ILE A 27 7.256 3.474 -6.086 1.00 0.00 H new ATOM 0 HG12 ILE A 27 8.738 1.711 -4.161 1.00 0.00 H new ATOM 0 HG13 ILE A 27 9.164 3.409 -4.221 1.00 0.00 H new ATOM 0 HG21 ILE A 27 6.633 1.108 -5.796 1.00 0.00 H new ATOM 0 HG22 ILE A 27 7.248 1.430 -7.435 1.00 0.00 H new ATOM 0 HG23 ILE A 27 8.287 0.622 -6.237 1.00 0.00 H new ATOM 0 HD11 ILE A 27 7.484 2.988 -2.493 1.00 0.00 H new ATOM 0 HD12 ILE A 27 6.816 4.029 -3.773 1.00 0.00 H new ATOM 0 HD13 ILE A 27 6.383 2.304 -3.713 1.00 0.00 H new ATOM 577 N ASP A 39 -5.979 7.875 -8.160 1.00 0.00 N ATOM 578 CA ASP A 39 -5.904 6.433 -8.363 1.00 0.00 C ATOM 579 C ASP A 39 -5.756 5.704 -7.031 1.00 0.00 C ATOM 580 O ASP A 39 -6.498 4.765 -6.740 1.00 0.00 O ATOM 581 CB ASP A 39 -4.730 6.087 -9.281 1.00 0.00 C ATOM 582 CG ASP A 39 -3.574 7.056 -9.134 1.00 0.00 C ATOM 583 OD1 ASP A 39 -3.752 8.247 -9.465 1.00 0.00 O ATOM 584 OD2 ASP A 39 -2.492 6.624 -8.686 1.00 0.00 O ATOM 0 HA ASP A 39 -6.832 6.108 -8.834 1.00 0.00 H new ATOM 0 HB2 ASP A 39 -4.384 5.077 -9.059 1.00 0.00 H new ATOM 0 HB3 ASP A 39 -5.070 6.087 -10.317 1.00 0.00 H new ATOM 589 N PHE A 40 -4.793 6.141 -6.227 1.00 0.00 N ATOM 590 CA PHE A 40 -4.546 5.528 -4.927 1.00 0.00 C ATOM 591 C PHE A 40 -5.858 5.264 -4.192 1.00 0.00 C ATOM 592 O PHE A 40 -5.998 4.263 -3.490 1.00 0.00 O ATOM 593 CB PHE A 40 -3.645 6.427 -4.078 1.00 0.00 C ATOM 594 CG PHE A 40 -2.180 6.155 -4.265 1.00 0.00 C ATOM 595 CD1 PHE A 40 -1.636 6.062 -5.535 1.00 0.00 C ATOM 596 CD2 PHE A 40 -1.347 5.993 -3.169 1.00 0.00 C ATOM 597 CE1 PHE A 40 -0.288 5.811 -5.710 1.00 0.00 C ATOM 598 CE2 PHE A 40 0.002 5.743 -3.338 1.00 0.00 C ATOM 599 CZ PHE A 40 0.532 5.653 -4.610 1.00 0.00 C ATOM 0 H PHE A 40 -4.171 6.917 -6.452 1.00 0.00 H new ATOM 0 HA PHE A 40 -4.044 4.575 -5.092 1.00 0.00 H new ATOM 0 HB2 PHE A 40 -3.848 7.469 -4.326 1.00 0.00 H new ATOM 0 HB3 PHE A 40 -3.900 6.294 -3.027 1.00 0.00 H new ATOM 0 HD1 PHE A 40 -2.272 6.187 -6.399 1.00 0.00 H new ATOM 0 HD2 PHE A 40 -1.756 6.063 -2.172 1.00 0.00 H new ATOM 0 HE1 PHE A 40 0.124 5.739 -6.706 1.00 0.00 H new ATOM 0 HE2 PHE A 40 0.641 5.618 -2.476 1.00 0.00 H new ATOM 0 HZ PHE A 40 1.586 5.459 -4.744 1.00 0.00 H new ATOM 609 N SER A 41 -6.815 6.171 -4.360 1.00 0.00 N ATOM 610 CA SER A 41 -8.114 6.039 -3.710 1.00 0.00 C ATOM 611 C SER A 41 -8.677 4.634 -3.901 1.00 0.00 C ATOM 612 O SER A 41 -9.256 4.056 -2.981 1.00 0.00 O ATOM 613 CB SER A 41 -9.094 7.074 -4.267 1.00 0.00 C ATOM 614 OG SER A 41 -10.381 6.918 -3.695 1.00 0.00 O ATOM 0 H SER A 41 -6.716 7.004 -4.940 1.00 0.00 H new ATOM 0 HA SER A 41 -7.978 6.215 -2.643 1.00 0.00 H new ATOM 0 HB2 SER A 41 -8.722 8.078 -4.064 1.00 0.00 H new ATOM 0 HB3 SER A 41 -9.159 6.971 -5.350 1.00 0.00 H new ATOM 0 HG SER A 41 -10.361 7.210 -2.760 1.00 0.00 H new ATOM 620 N ASP A 42 -8.503 4.092 -5.101 1.00 0.00 N ATOM 621 CA ASP A 42 -8.993 2.755 -5.414 1.00 0.00 C ATOM 622 C ASP A 42 -8.410 1.724 -4.452 1.00 0.00 C ATOM 623 O ASP A 42 -9.117 0.840 -3.970 1.00 0.00 O ATOM 624 CB ASP A 42 -8.640 2.383 -6.855 1.00 0.00 C ATOM 625 CG ASP A 42 -9.315 3.287 -7.868 1.00 0.00 C ATOM 626 OD1 ASP A 42 -9.146 4.521 -7.767 1.00 0.00 O ATOM 627 OD2 ASP A 42 -10.010 2.761 -8.761 1.00 0.00 O ATOM 0 H ASP A 42 -8.026 4.558 -5.873 1.00 0.00 H new ATOM 0 HA ASP A 42 -10.077 2.757 -5.303 1.00 0.00 H new ATOM 0 HB2 ASP A 42 -7.559 2.437 -6.987 1.00 0.00 H new ATOM 0 HB3 ASP A 42 -8.932 1.350 -7.043 1.00 0.00 H new ATOM 632 N GLY A 43 -7.114 1.843 -4.179 1.00 0.00 N ATOM 633 CA GLY A 43 -6.457 0.914 -3.278 1.00 0.00 C ATOM 634 C GLY A 43 -5.451 0.031 -3.988 1.00 0.00 C ATOM 635 O GLY A 43 -4.381 -0.261 -3.452 1.00 0.00 O ATOM 0 H GLY A 43 -6.507 2.566 -4.566 1.00 0.00 H new ATOM 0 HA2 GLY A 43 -5.953 1.473 -2.490 1.00 0.00 H new ATOM 0 HA3 GLY A 43 -7.208 0.288 -2.795 1.00 0.00 H new ATOM 639 N VAL A 44 -5.793 -0.399 -5.199 1.00 0.00 N ATOM 640 CA VAL A 44 -4.912 -1.256 -5.983 1.00 0.00 C ATOM 641 C VAL A 44 -3.477 -0.743 -5.952 1.00 0.00 C ATOM 642 O VAL A 44 -2.546 -1.489 -5.646 1.00 0.00 O ATOM 643 CB VAL A 44 -5.380 -1.352 -7.448 1.00 0.00 C ATOM 644 CG1 VAL A 44 -4.320 -2.027 -8.304 1.00 0.00 C ATOM 645 CG2 VAL A 44 -6.703 -2.097 -7.536 1.00 0.00 C ATOM 0 H VAL A 44 -6.674 -0.168 -5.658 1.00 0.00 H new ATOM 0 HA VAL A 44 -4.950 -2.247 -5.532 1.00 0.00 H new ATOM 0 HB VAL A 44 -5.532 -0.343 -7.830 1.00 0.00 H new ATOM 0 HG11 VAL A 44 -4.668 -2.086 -9.335 1.00 0.00 H new ATOM 0 HG12 VAL A 44 -3.398 -1.448 -8.265 1.00 0.00 H new ATOM 0 HG13 VAL A 44 -4.133 -3.032 -7.926 1.00 0.00 H new ATOM 0 HG21 VAL A 44 -7.019 -2.156 -8.578 1.00 0.00 H new ATOM 0 HG22 VAL A 44 -6.581 -3.104 -7.137 1.00 0.00 H new ATOM 0 HG23 VAL A 44 -7.459 -1.566 -6.957 1.00 0.00 H new ATOM 655 N LEU A 45 -3.304 0.535 -6.272 1.00 0.00 N ATOM 656 CA LEU A 45 -1.981 1.149 -6.281 1.00 0.00 C ATOM 657 C LEU A 45 -1.241 0.866 -4.977 1.00 0.00 C ATOM 658 O LEU A 45 -0.146 0.302 -4.983 1.00 0.00 O ATOM 659 CB LEU A 45 -2.100 2.659 -6.496 1.00 0.00 C ATOM 660 CG LEU A 45 -2.097 3.132 -7.950 1.00 0.00 C ATOM 661 CD1 LEU A 45 -0.726 2.927 -8.575 1.00 0.00 C ATOM 662 CD2 LEU A 45 -3.166 2.402 -8.750 1.00 0.00 C ATOM 0 H LEU A 45 -4.063 1.166 -6.529 1.00 0.00 H new ATOM 0 HA LEU A 45 -1.411 0.715 -7.102 1.00 0.00 H new ATOM 0 HB2 LEU A 45 -3.022 3.001 -6.025 1.00 0.00 H new ATOM 0 HB3 LEU A 45 -1.276 3.146 -5.975 1.00 0.00 H new ATOM 0 HG LEU A 45 -2.324 4.198 -7.966 1.00 0.00 H new ATOM 0 HD11 LEU A 45 -0.743 3.269 -9.610 1.00 0.00 H new ATOM 0 HD12 LEU A 45 0.017 3.496 -8.017 1.00 0.00 H new ATOM 0 HD13 LEU A 45 -0.468 1.868 -8.547 1.00 0.00 H new ATOM 0 HD21 LEU A 45 -3.150 2.751 -9.782 1.00 0.00 H new ATOM 0 HD22 LEU A 45 -2.970 1.330 -8.726 1.00 0.00 H new ATOM 0 HD23 LEU A 45 -4.145 2.601 -8.315 1.00 0.00 H new ATOM 674 N VAL A 46 -1.846 1.260 -3.861 1.00 0.00 N ATOM 675 CA VAL A 46 -1.246 1.046 -2.550 1.00 0.00 C ATOM 676 C VAL A 46 -0.645 -0.351 -2.442 1.00 0.00 C ATOM 677 O VAL A 46 0.404 -0.541 -1.827 1.00 0.00 O ATOM 678 CB VAL A 46 -2.278 1.237 -1.423 1.00 0.00 C ATOM 679 CG1 VAL A 46 -1.645 0.964 -0.067 1.00 0.00 C ATOM 680 CG2 VAL A 46 -2.868 2.638 -1.473 1.00 0.00 C ATOM 0 H VAL A 46 -2.751 1.729 -3.839 1.00 0.00 H new ATOM 0 HA VAL A 46 -0.455 1.788 -2.439 1.00 0.00 H new ATOM 0 HB VAL A 46 -3.087 0.521 -1.570 1.00 0.00 H new ATOM 0 HG11 VAL A 46 -2.389 1.104 0.717 1.00 0.00 H new ATOM 0 HG12 VAL A 46 -1.276 -0.061 -0.038 1.00 0.00 H new ATOM 0 HG13 VAL A 46 -0.816 1.653 0.093 1.00 0.00 H new ATOM 0 HG21 VAL A 46 -3.595 2.755 -0.670 1.00 0.00 H new ATOM 0 HG22 VAL A 46 -2.072 3.373 -1.352 1.00 0.00 H new ATOM 0 HG23 VAL A 46 -3.360 2.791 -2.433 1.00 0.00 H new ATOM 690 N ALA A 47 -1.317 -1.327 -3.044 1.00 0.00 N ATOM 691 CA ALA A 47 -0.848 -2.707 -3.018 1.00 0.00 C ATOM 692 C ALA A 47 0.450 -2.860 -3.804 1.00 0.00 C ATOM 693 O ALA A 47 1.440 -3.378 -3.289 1.00 0.00 O ATOM 694 CB ALA A 47 -1.916 -3.638 -3.573 1.00 0.00 C ATOM 0 H ALA A 47 -2.188 -1.187 -3.556 1.00 0.00 H new ATOM 0 HA ALA A 47 -0.649 -2.978 -1.981 1.00 0.00 H new ATOM 0 HB1 ALA A 47 -1.552 -4.665 -3.548 1.00 0.00 H new ATOM 0 HB2 ALA A 47 -2.819 -3.558 -2.968 1.00 0.00 H new ATOM 0 HB3 ALA A 47 -2.143 -3.359 -4.602 1.00 0.00 H new ATOM 700 N GLU A 48 0.437 -2.407 -5.054 1.00 0.00 N ATOM 701 CA GLU A 48 1.614 -2.497 -5.911 1.00 0.00 C ATOM 702 C GLU A 48 2.849 -1.956 -5.196 1.00 0.00 C ATOM 703 O GLU A 48 3.919 -2.562 -5.238 1.00 0.00 O ATOM 704 CB GLU A 48 1.385 -1.725 -7.212 1.00 0.00 C ATOM 705 CG GLU A 48 0.251 -2.281 -8.057 1.00 0.00 C ATOM 706 CD GLU A 48 0.349 -3.781 -8.252 1.00 0.00 C ATOM 707 OE1 GLU A 48 1.417 -4.254 -8.695 1.00 0.00 O ATOM 708 OE2 GLU A 48 -0.642 -4.483 -7.960 1.00 0.00 O ATOM 0 H GLU A 48 -0.374 -1.974 -5.495 1.00 0.00 H new ATOM 0 HA GLU A 48 1.782 -3.548 -6.146 1.00 0.00 H new ATOM 0 HB2 GLU A 48 1.172 -0.683 -6.974 1.00 0.00 H new ATOM 0 HB3 GLU A 48 2.304 -1.737 -7.798 1.00 0.00 H new ATOM 0 HG2 GLU A 48 -0.701 -2.042 -7.583 1.00 0.00 H new ATOM 0 HG3 GLU A 48 0.255 -1.791 -9.031 1.00 0.00 H new ATOM 715 N VAL A 49 2.692 -0.810 -4.541 1.00 0.00 N ATOM 716 CA VAL A 49 3.793 -0.186 -3.817 1.00 0.00 C ATOM 717 C VAL A 49 4.493 -1.191 -2.909 1.00 0.00 C ATOM 718 O VAL A 49 5.715 -1.335 -2.951 1.00 0.00 O ATOM 719 CB VAL A 49 3.304 1.002 -2.968 1.00 0.00 C ATOM 720 CG1 VAL A 49 4.439 1.553 -2.117 1.00 0.00 C ATOM 721 CG2 VAL A 49 2.720 2.088 -3.858 1.00 0.00 C ATOM 0 H VAL A 49 1.813 -0.295 -4.497 1.00 0.00 H new ATOM 0 HA VAL A 49 4.498 0.177 -4.565 1.00 0.00 H new ATOM 0 HB VAL A 49 2.518 0.649 -2.300 1.00 0.00 H new ATOM 0 HG11 VAL A 49 4.075 2.392 -1.524 1.00 0.00 H new ATOM 0 HG12 VAL A 49 4.808 0.772 -1.452 1.00 0.00 H new ATOM 0 HG13 VAL A 49 5.248 1.891 -2.764 1.00 0.00 H new ATOM 0 HG21 VAL A 49 2.379 2.920 -3.241 1.00 0.00 H new ATOM 0 HG22 VAL A 49 3.484 2.440 -4.552 1.00 0.00 H new ATOM 0 HG23 VAL A 49 1.878 1.684 -4.420 1.00 0.00 H new ATOM 731 N ILE A 50 3.710 -1.885 -2.089 1.00 0.00 N ATOM 732 CA ILE A 50 4.255 -2.878 -1.172 1.00 0.00 C ATOM 733 C ILE A 50 5.108 -3.902 -1.913 1.00 0.00 C ATOM 734 O ILE A 50 6.173 -4.299 -1.441 1.00 0.00 O ATOM 735 CB ILE A 50 3.137 -3.614 -0.409 1.00 0.00 C ATOM 736 CG1 ILE A 50 2.266 -2.613 0.353 1.00 0.00 C ATOM 737 CG2 ILE A 50 3.732 -4.640 0.543 1.00 0.00 C ATOM 738 CD1 ILE A 50 0.892 -3.145 0.694 1.00 0.00 C ATOM 0 H ILE A 50 2.697 -1.778 -2.041 1.00 0.00 H new ATOM 0 HA ILE A 50 4.877 -2.339 -0.458 1.00 0.00 H new ATOM 0 HB ILE A 50 2.509 -4.138 -1.130 1.00 0.00 H new ATOM 0 HG12 ILE A 50 2.775 -2.328 1.274 1.00 0.00 H new ATOM 0 HG13 ILE A 50 2.158 -1.708 -0.245 1.00 0.00 H new ATOM 0 HG21 ILE A 50 2.930 -5.151 1.075 1.00 0.00 H new ATOM 0 HG22 ILE A 50 4.313 -5.368 -0.023 1.00 0.00 H new ATOM 0 HG23 ILE A 50 4.380 -4.137 1.261 1.00 0.00 H new ATOM 0 HD11 ILE A 50 0.330 -2.382 1.233 1.00 0.00 H new ATOM 0 HD12 ILE A 50 0.364 -3.404 -0.224 1.00 0.00 H new ATOM 0 HD13 ILE A 50 0.990 -4.033 1.319 1.00 0.00 H new ATOM 750 N LYS A 51 4.633 -4.325 -3.080 1.00 0.00 N ATOM 751 CA LYS A 51 5.352 -5.301 -3.891 1.00 0.00 C ATOM 752 C LYS A 51 6.858 -5.071 -3.810 1.00 0.00 C ATOM 753 O LYS A 51 7.615 -5.972 -3.452 1.00 0.00 O ATOM 754 CB LYS A 51 4.890 -5.223 -5.348 1.00 0.00 C ATOM 755 CG LYS A 51 5.074 -6.522 -6.114 1.00 0.00 C ATOM 756 CD LYS A 51 6.525 -6.730 -6.517 1.00 0.00 C ATOM 757 CE LYS A 51 6.720 -8.062 -7.225 1.00 0.00 C ATOM 758 NZ LYS A 51 6.065 -8.082 -8.562 1.00 0.00 N ATOM 0 H LYS A 51 3.753 -4.007 -3.485 1.00 0.00 H new ATOM 0 HA LYS A 51 5.133 -6.294 -3.500 1.00 0.00 H new ATOM 0 HB2 LYS A 51 3.837 -4.943 -5.372 1.00 0.00 H new ATOM 0 HB3 LYS A 51 5.442 -4.431 -5.854 1.00 0.00 H new ATOM 0 HG2 LYS A 51 4.743 -7.359 -5.499 1.00 0.00 H new ATOM 0 HG3 LYS A 51 4.446 -6.513 -7.005 1.00 0.00 H new ATOM 0 HD2 LYS A 51 6.842 -5.918 -7.172 1.00 0.00 H new ATOM 0 HD3 LYS A 51 7.159 -6.691 -5.631 1.00 0.00 H new ATOM 0 HE2 LYS A 51 7.786 -8.259 -7.340 1.00 0.00 H new ATOM 0 HE3 LYS A 51 6.312 -8.864 -6.609 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 6.306 -8.966 -9.053 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 5.033 -8.021 -8.444 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 6.398 -7.272 -9.124 1.00 0.00 H new ATOM 772 N PHE A 52 7.285 -3.858 -4.146 1.00 0.00 N ATOM 773 CA PHE A 52 8.701 -3.509 -4.111 1.00 0.00 C ATOM 774 C PHE A 52 9.363 -4.050 -2.847 1.00 0.00 C ATOM 775 O PHE A 52 10.455 -4.616 -2.899 1.00 0.00 O ATOM 776 CB PHE A 52 8.876 -1.991 -4.183 1.00 0.00 C ATOM 777 CG PHE A 52 10.292 -1.540 -3.966 1.00 0.00 C ATOM 778 CD1 PHE A 52 11.231 -1.653 -4.978 1.00 0.00 C ATOM 779 CD2 PHE A 52 10.684 -1.003 -2.750 1.00 0.00 C ATOM 780 CE1 PHE A 52 12.535 -1.238 -4.782 1.00 0.00 C ATOM 781 CE2 PHE A 52 11.986 -0.587 -2.549 1.00 0.00 C ATOM 782 CZ PHE A 52 12.913 -0.706 -3.566 1.00 0.00 C ATOM 0 H PHE A 52 6.671 -3.100 -4.446 1.00 0.00 H new ATOM 0 HA PHE A 52 9.184 -3.964 -4.976 1.00 0.00 H new ATOM 0 HB2 PHE A 52 8.537 -1.640 -5.158 1.00 0.00 H new ATOM 0 HB3 PHE A 52 8.236 -1.524 -3.435 1.00 0.00 H new ATOM 0 HD1 PHE A 52 10.941 -2.070 -5.931 1.00 0.00 H new ATOM 0 HD2 PHE A 52 9.964 -0.909 -1.951 1.00 0.00 H new ATOM 0 HE1 PHE A 52 13.257 -1.330 -5.580 1.00 0.00 H new ATOM 0 HE2 PHE A 52 12.279 -0.169 -1.597 1.00 0.00 H new ATOM 0 HZ PHE A 52 13.932 -0.383 -3.410 1.00 0.00 H new ATOM 792 N TYR A 53 8.694 -3.870 -1.713 1.00 0.00 N ATOM 793 CA TYR A 53 9.218 -4.336 -0.435 1.00 0.00 C ATOM 794 C TYR A 53 9.066 -5.848 -0.302 1.00 0.00 C ATOM 795 O TYR A 53 10.001 -6.546 0.091 1.00 0.00 O ATOM 796 CB TYR A 53 8.500 -3.637 0.720 1.00 0.00 C ATOM 797 CG TYR A 53 8.908 -2.193 0.902 1.00 0.00 C ATOM 798 CD1 TYR A 53 8.497 -1.215 0.005 1.00 0.00 C ATOM 799 CD2 TYR A 53 9.705 -1.805 1.972 1.00 0.00 C ATOM 800 CE1 TYR A 53 8.869 0.105 0.166 1.00 0.00 C ATOM 801 CE2 TYR A 53 10.081 -0.487 2.143 1.00 0.00 C ATOM 802 CZ TYR A 53 9.660 0.465 1.237 1.00 0.00 C ATOM 803 OH TYR A 53 10.032 1.779 1.403 1.00 0.00 O ATOM 0 H TYR A 53 7.788 -3.405 -1.653 1.00 0.00 H new ATOM 0 HA TYR A 53 10.279 -4.091 -0.396 1.00 0.00 H new ATOM 0 HB2 TYR A 53 7.424 -3.683 0.549 1.00 0.00 H new ATOM 0 HB3 TYR A 53 8.700 -4.181 1.643 1.00 0.00 H new ATOM 0 HD1 TYR A 53 7.875 -1.492 -0.833 1.00 0.00 H new ATOM 0 HD2 TYR A 53 10.036 -2.547 2.683 1.00 0.00 H new ATOM 0 HE1 TYR A 53 8.542 0.851 -0.543 1.00 0.00 H new ATOM 0 HE2 TYR A 53 10.701 -0.203 2.981 1.00 0.00 H new ATOM 0 HH TYR A 53 10.587 1.863 2.206 1.00 0.00 H new ATOM 813 N PHE A 54 7.880 -6.348 -0.635 1.00 0.00 N ATOM 814 CA PHE A 54 7.603 -7.778 -0.553 1.00 0.00 C ATOM 815 C PHE A 54 6.621 -8.204 -1.641 1.00 0.00 C ATOM 816 O PHE A 54 5.493 -7.718 -1.719 1.00 0.00 O ATOM 817 CB PHE A 54 7.041 -8.132 0.825 1.00 0.00 C ATOM 818 CG PHE A 54 7.884 -7.632 1.963 1.00 0.00 C ATOM 819 CD1 PHE A 54 8.980 -8.357 2.401 1.00 0.00 C ATOM 820 CD2 PHE A 54 7.580 -6.437 2.595 1.00 0.00 C ATOM 821 CE1 PHE A 54 9.759 -7.899 3.448 1.00 0.00 C ATOM 822 CE2 PHE A 54 8.354 -5.974 3.641 1.00 0.00 C ATOM 823 CZ PHE A 54 9.444 -6.706 4.070 1.00 0.00 C ATOM 0 H PHE A 54 7.096 -5.785 -0.964 1.00 0.00 H new ATOM 0 HA PHE A 54 8.540 -8.314 -0.703 1.00 0.00 H new ATOM 0 HB2 PHE A 54 6.038 -7.716 0.917 1.00 0.00 H new ATOM 0 HB3 PHE A 54 6.946 -9.215 0.902 1.00 0.00 H new ATOM 0 HD1 PHE A 54 9.229 -9.291 1.919 1.00 0.00 H new ATOM 0 HD2 PHE A 54 6.728 -5.861 2.266 1.00 0.00 H new ATOM 0 HE1 PHE A 54 10.612 -8.473 3.779 1.00 0.00 H new ATOM 0 HE2 PHE A 54 8.107 -5.040 4.123 1.00 0.00 H new ATOM 0 HZ PHE A 54 10.049 -6.347 4.890 1.00 0.00 H new ATOM 833 N PRO A 55 7.060 -9.135 -2.501 1.00 0.00 N ATOM 834 CA PRO A 55 6.236 -9.648 -3.600 1.00 0.00 C ATOM 835 C PRO A 55 5.080 -10.510 -3.104 1.00 0.00 C ATOM 836 O PRO A 55 3.974 -10.454 -3.642 1.00 0.00 O ATOM 837 CB PRO A 55 7.219 -10.490 -4.417 1.00 0.00 C ATOM 838 CG PRO A 55 8.270 -10.897 -3.443 1.00 0.00 C ATOM 839 CD PRO A 55 8.393 -9.759 -2.467 1.00 0.00 C ATOM 0 HA PRO A 55 5.768 -8.844 -4.168 1.00 0.00 H new ATOM 0 HB2 PRO A 55 6.727 -11.359 -4.855 1.00 0.00 H new ATOM 0 HB3 PRO A 55 7.643 -9.915 -5.240 1.00 0.00 H new ATOM 0 HG2 PRO A 55 7.993 -11.820 -2.933 1.00 0.00 H new ATOM 0 HG3 PRO A 55 9.218 -11.083 -3.947 1.00 0.00 H new ATOM 0 HD2 PRO A 55 8.646 -10.112 -1.467 1.00 0.00 H new ATOM 0 HD3 PRO A 55 9.173 -9.058 -2.764 1.00 0.00 H new ATOM 847 N LYS A 56 5.343 -11.308 -2.074 1.00 0.00 N ATOM 848 CA LYS A 56 4.324 -12.182 -1.503 1.00 0.00 C ATOM 849 C LYS A 56 3.202 -11.367 -0.869 1.00 0.00 C ATOM 850 O LYS A 56 2.031 -11.536 -1.207 1.00 0.00 O ATOM 851 CB LYS A 56 4.947 -13.111 -0.460 1.00 0.00 C ATOM 852 CG LYS A 56 5.632 -12.376 0.679 1.00 0.00 C ATOM 853 CD LYS A 56 6.579 -13.287 1.442 1.00 0.00 C ATOM 854 CE LYS A 56 5.819 -14.281 2.307 1.00 0.00 C ATOM 855 NZ LYS A 56 6.734 -15.074 3.174 1.00 0.00 N ATOM 0 H LYS A 56 6.253 -11.368 -1.618 1.00 0.00 H new ATOM 0 HA LYS A 56 3.902 -12.782 -2.309 1.00 0.00 H new ATOM 0 HB2 LYS A 56 4.170 -13.756 -0.050 1.00 0.00 H new ATOM 0 HB3 LYS A 56 5.673 -13.760 -0.951 1.00 0.00 H new ATOM 0 HG2 LYS A 56 6.185 -11.524 0.283 1.00 0.00 H new ATOM 0 HG3 LYS A 56 4.880 -11.978 1.361 1.00 0.00 H new ATOM 0 HD2 LYS A 56 7.213 -13.826 0.738 1.00 0.00 H new ATOM 0 HD3 LYS A 56 7.238 -12.686 2.069 1.00 0.00 H new ATOM 0 HE2 LYS A 56 5.101 -13.747 2.929 1.00 0.00 H new ATOM 0 HE3 LYS A 56 5.248 -14.955 1.669 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 6.178 -15.740 3.748 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 7.403 -15.604 2.580 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 7.261 -14.433 3.801 1.00 0.00 H new ATOM 869 N MET A 57 3.568 -10.481 0.053 1.00 0.00 N ATOM 870 CA MET A 57 2.591 -9.638 0.732 1.00 0.00 C ATOM 871 C MET A 57 1.483 -9.210 -0.224 1.00 0.00 C ATOM 872 O MET A 57 0.301 -9.428 0.042 1.00 0.00 O ATOM 873 CB MET A 57 3.275 -8.404 1.324 1.00 0.00 C ATOM 874 CG MET A 57 4.051 -8.692 2.599 1.00 0.00 C ATOM 875 SD MET A 57 4.674 -7.194 3.386 1.00 0.00 S ATOM 876 CE MET A 57 3.221 -6.653 4.282 1.00 0.00 C ATOM 0 H MET A 57 4.533 -10.329 0.346 1.00 0.00 H new ATOM 0 HA MET A 57 2.145 -10.220 1.539 1.00 0.00 H new ATOM 0 HB2 MET A 57 3.954 -7.984 0.582 1.00 0.00 H new ATOM 0 HB3 MET A 57 2.521 -7.645 1.531 1.00 0.00 H new ATOM 0 HG2 MET A 57 3.407 -9.225 3.299 1.00 0.00 H new ATOM 0 HG3 MET A 57 4.888 -9.352 2.369 1.00 0.00 H new ATOM 0 HE1 MET A 57 3.525 -6.180 5.216 1.00 0.00 H new ATOM 0 HE2 MET A 57 2.666 -5.937 3.676 1.00 0.00 H new ATOM 0 HE3 MET A 57 2.587 -7.512 4.500 1.00 0.00 H new ATOM 886 N VAL A 58 1.873 -8.600 -1.339 1.00 0.00 N ATOM 887 CA VAL A 58 0.912 -8.142 -2.336 1.00 0.00 C ATOM 888 C VAL A 58 0.179 -9.317 -2.973 1.00 0.00 C ATOM 889 O VAL A 58 0.783 -10.136 -3.664 1.00 0.00 O ATOM 890 CB VAL A 58 1.600 -7.319 -3.442 1.00 0.00 C ATOM 891 CG1 VAL A 58 0.612 -6.980 -4.548 1.00 0.00 C ATOM 892 CG2 VAL A 58 2.217 -6.056 -2.860 1.00 0.00 C ATOM 0 H VAL A 58 2.847 -8.412 -1.575 1.00 0.00 H new ATOM 0 HA VAL A 58 0.194 -7.509 -1.816 1.00 0.00 H new ATOM 0 HB VAL A 58 2.400 -7.920 -3.875 1.00 0.00 H new ATOM 0 HG11 VAL A 58 1.116 -6.399 -5.320 1.00 0.00 H new ATOM 0 HG12 VAL A 58 0.223 -7.901 -4.983 1.00 0.00 H new ATOM 0 HG13 VAL A 58 -0.211 -6.398 -4.134 1.00 0.00 H new ATOM 0 HG21 VAL A 58 2.699 -5.487 -3.655 1.00 0.00 H new ATOM 0 HG22 VAL A 58 1.437 -5.449 -2.400 1.00 0.00 H new ATOM 0 HG23 VAL A 58 2.958 -6.326 -2.107 1.00 0.00 H new ATOM 902 N GLU A 59 -1.127 -9.392 -2.735 1.00 0.00 N ATOM 903 CA GLU A 59 -1.943 -10.468 -3.286 1.00 0.00 C ATOM 904 C GLU A 59 -3.021 -9.913 -4.212 1.00 0.00 C ATOM 905 O GLU A 59 -4.061 -9.438 -3.756 1.00 0.00 O ATOM 906 CB GLU A 59 -2.589 -11.276 -2.159 1.00 0.00 C ATOM 907 CG GLU A 59 -3.060 -12.654 -2.592 1.00 0.00 C ATOM 908 CD GLU A 59 -1.935 -13.670 -2.630 1.00 0.00 C ATOM 909 OE1 GLU A 59 -0.765 -13.254 -2.767 1.00 0.00 O ATOM 910 OE2 GLU A 59 -2.223 -14.880 -2.524 1.00 0.00 O ATOM 0 H GLU A 59 -1.642 -8.721 -2.165 1.00 0.00 H new ATOM 0 HA GLU A 59 -1.293 -11.123 -3.866 1.00 0.00 H new ATOM 0 HB2 GLU A 59 -1.873 -11.385 -1.345 1.00 0.00 H new ATOM 0 HB3 GLU A 59 -3.438 -10.718 -1.764 1.00 0.00 H new ATOM 0 HG2 GLU A 59 -3.835 -13.001 -1.908 1.00 0.00 H new ATOM 0 HG3 GLU A 59 -3.515 -12.584 -3.580 1.00 0.00 H new ATOM 917 N MET A 60 -2.765 -9.977 -5.514 1.00 0.00 N ATOM 918 CA MET A 60 -3.714 -9.482 -6.505 1.00 0.00 C ATOM 919 C MET A 60 -4.681 -10.583 -6.929 1.00 0.00 C ATOM 920 O MET A 60 -4.835 -10.864 -8.118 1.00 0.00 O ATOM 921 CB MET A 60 -2.971 -8.941 -7.728 1.00 0.00 C ATOM 922 CG MET A 60 -1.996 -7.822 -7.401 1.00 0.00 C ATOM 923 SD MET A 60 -2.745 -6.515 -6.410 1.00 0.00 S ATOM 924 CE MET A 60 -3.916 -5.832 -7.580 1.00 0.00 C ATOM 0 H MET A 60 -1.909 -10.367 -5.908 1.00 0.00 H new ATOM 0 HA MET A 60 -4.288 -8.674 -6.051 1.00 0.00 H new ATOM 0 HB2 MET A 60 -2.428 -9.758 -8.203 1.00 0.00 H new ATOM 0 HB3 MET A 60 -3.699 -8.577 -8.453 1.00 0.00 H new ATOM 0 HG2 MET A 60 -1.142 -8.235 -6.865 1.00 0.00 H new ATOM 0 HG3 MET A 60 -1.614 -7.396 -8.329 1.00 0.00 H new ATOM 0 HE1 MET A 60 -4.520 -5.070 -7.087 1.00 0.00 H new ATOM 0 HE2 MET A 60 -3.377 -5.384 -8.415 1.00 0.00 H new ATOM 0 HE3 MET A 60 -4.564 -6.626 -7.951 1.00 0.00 H new ATOM 934 N HIS A 61 -5.331 -11.203 -5.949 1.00 0.00 N ATOM 935 CA HIS A 61 -6.284 -12.273 -6.221 1.00 0.00 C ATOM 936 C HIS A 61 -7.704 -11.839 -5.872 1.00 0.00 C ATOM 937 O HIS A 61 -8.655 -12.162 -6.582 1.00 0.00 O ATOM 938 CB HIS A 61 -5.913 -13.528 -5.431 1.00 0.00 C ATOM 939 CG HIS A 61 -6.855 -14.673 -5.647 1.00 0.00 C ATOM 940 ND1 HIS A 61 -6.686 -15.607 -6.647 1.00 0.00 N ATOM 941 CD2 HIS A 61 -7.979 -15.032 -4.984 1.00 0.00 C ATOM 942 CE1 HIS A 61 -7.667 -16.490 -6.591 1.00 0.00 C ATOM 943 NE2 HIS A 61 -8.465 -16.164 -5.590 1.00 0.00 N ATOM 0 H HIS A 61 -5.215 -10.983 -4.960 1.00 0.00 H new ATOM 0 HA HIS A 61 -6.244 -12.498 -7.287 1.00 0.00 H new ATOM 0 HB2 HIS A 61 -4.906 -13.839 -5.711 1.00 0.00 H new ATOM 0 HB3 HIS A 61 -5.888 -13.284 -4.369 1.00 0.00 H new ATOM 0 HD2 HIS A 61 -8.413 -14.523 -4.136 1.00 0.00 H new ATOM 0 HE1 HIS A 61 -7.795 -17.335 -7.251 1.00 0.00 H new ATOM 0 HE2 HIS A 61 -9.306 -16.671 -5.312 1.00 0.00 H new ATOM 952 N ASN A 62 -7.839 -11.105 -4.772 1.00 0.00 N ATOM 953 CA ASN A 62 -9.143 -10.627 -4.328 1.00 0.00 C ATOM 954 C ASN A 62 -9.351 -9.168 -4.722 1.00 0.00 C ATOM 955 O ASN A 62 -10.483 -8.717 -4.899 1.00 0.00 O ATOM 956 CB ASN A 62 -9.276 -10.781 -2.811 1.00 0.00 C ATOM 957 CG ASN A 62 -8.140 -10.113 -2.060 1.00 0.00 C ATOM 958 OD1 ASN A 62 -8.222 -8.937 -1.706 1.00 0.00 O ATOM 959 ND2 ASN A 62 -7.073 -10.864 -1.814 1.00 0.00 N ATOM 0 H ASN A 62 -7.062 -10.829 -4.172 1.00 0.00 H new ATOM 0 HA ASN A 62 -9.909 -11.229 -4.817 1.00 0.00 H new ATOM 0 HB2 ASN A 62 -10.224 -10.352 -2.487 1.00 0.00 H new ATOM 0 HB3 ASN A 62 -9.302 -11.841 -2.557 1.00 0.00 H new ATOM 0 HD21 ASN A 62 -6.277 -10.470 -1.312 1.00 0.00 H new ATOM 0 HD22 ASN A 62 -7.049 -11.835 -2.127 1.00 0.00 H new ATOM 966 N TYR A 63 -8.252 -8.435 -4.857 1.00 0.00 N ATOM 967 CA TYR A 63 -8.313 -7.026 -5.229 1.00 0.00 C ATOM 968 C TYR A 63 -8.538 -6.868 -6.730 1.00 0.00 C ATOM 969 O TYR A 63 -8.070 -7.679 -7.529 1.00 0.00 O ATOM 970 CB TYR A 63 -7.024 -6.312 -4.817 1.00 0.00 C ATOM 971 CG TYR A 63 -6.615 -6.578 -3.386 1.00 0.00 C ATOM 972 CD1 TYR A 63 -7.481 -6.311 -2.334 1.00 0.00 C ATOM 973 CD2 TYR A 63 -5.362 -7.098 -3.087 1.00 0.00 C ATOM 974 CE1 TYR A 63 -7.111 -6.553 -1.025 1.00 0.00 C ATOM 975 CE2 TYR A 63 -4.983 -7.344 -1.782 1.00 0.00 C ATOM 976 CZ TYR A 63 -5.861 -7.069 -0.754 1.00 0.00 C ATOM 977 OH TYR A 63 -5.489 -7.312 0.548 1.00 0.00 O ATOM 0 H TYR A 63 -7.308 -8.793 -4.714 1.00 0.00 H new ATOM 0 HA TYR A 63 -9.155 -6.574 -4.704 1.00 0.00 H new ATOM 0 HB2 TYR A 63 -6.218 -6.624 -5.481 1.00 0.00 H new ATOM 0 HB3 TYR A 63 -7.153 -5.239 -4.956 1.00 0.00 H new ATOM 0 HD1 TYR A 63 -8.461 -5.907 -2.543 1.00 0.00 H new ATOM 0 HD2 TYR A 63 -4.672 -7.314 -3.889 1.00 0.00 H new ATOM 0 HE1 TYR A 63 -7.797 -6.339 -0.218 1.00 0.00 H new ATOM 0 HE2 TYR A 63 -4.005 -7.749 -1.567 1.00 0.00 H new ATOM 0 HH TYR A 63 -4.579 -7.676 0.566 1.00 0.00 H new ATOM 987 N VAL A 64 -9.259 -5.816 -7.105 1.00 0.00 N ATOM 988 CA VAL A 64 -9.546 -5.548 -8.509 1.00 0.00 C ATOM 989 C VAL A 64 -9.862 -4.074 -8.734 1.00 0.00 C ATOM 990 O VAL A 64 -10.566 -3.437 -7.950 1.00 0.00 O ATOM 991 CB VAL A 64 -10.728 -6.397 -9.012 1.00 0.00 C ATOM 992 CG1 VAL A 64 -11.042 -6.070 -10.464 1.00 0.00 C ATOM 993 CG2 VAL A 64 -10.429 -7.879 -8.844 1.00 0.00 C ATOM 0 H VAL A 64 -9.655 -5.136 -6.456 1.00 0.00 H new ATOM 0 HA VAL A 64 -8.651 -5.815 -9.071 1.00 0.00 H new ATOM 0 HB VAL A 64 -11.606 -6.156 -8.413 1.00 0.00 H new ATOM 0 HG11 VAL A 64 -11.880 -6.680 -10.801 1.00 0.00 H new ATOM 0 HG12 VAL A 64 -11.303 -5.015 -10.551 1.00 0.00 H new ATOM 0 HG13 VAL A 64 -10.169 -6.280 -11.081 1.00 0.00 H new ATOM 0 HG21 VAL A 64 -11.275 -8.464 -9.205 1.00 0.00 H new ATOM 0 HG22 VAL A 64 -9.538 -8.138 -9.417 1.00 0.00 H new ATOM 0 HG23 VAL A 64 -10.259 -8.099 -7.790 1.00 0.00 H new ATOM 1003 N PRO A 65 -9.330 -3.515 -9.832 1.00 0.00 N ATOM 1004 CA PRO A 65 -9.542 -2.109 -10.187 1.00 0.00 C ATOM 1005 C PRO A 65 -10.977 -1.831 -10.622 1.00 0.00 C ATOM 1006 O PRO A 65 -11.449 -2.376 -11.619 1.00 0.00 O ATOM 1007 CB PRO A 65 -8.577 -1.888 -11.354 1.00 0.00 C ATOM 1008 CG PRO A 65 -8.391 -3.240 -11.953 1.00 0.00 C ATOM 1009 CD PRO A 65 -8.480 -4.214 -10.811 1.00 0.00 C ATOM 0 HA PRO A 65 -9.368 -1.444 -9.341 1.00 0.00 H new ATOM 0 HB2 PRO A 65 -8.988 -1.186 -12.080 1.00 0.00 H new ATOM 0 HB3 PRO A 65 -7.629 -1.473 -11.011 1.00 0.00 H new ATOM 0 HG2 PRO A 65 -9.157 -3.444 -12.701 1.00 0.00 H new ATOM 0 HG3 PRO A 65 -7.427 -3.315 -12.456 1.00 0.00 H new ATOM 0 HD2 PRO A 65 -8.922 -5.160 -11.123 1.00 0.00 H new ATOM 0 HD3 PRO A 65 -7.497 -4.442 -10.399 1.00 0.00 H new ATOM 1017 N ALA A 66 -11.664 -0.979 -9.868 1.00 0.00 N ATOM 1018 CA ALA A 66 -13.044 -0.627 -10.178 1.00 0.00 C ATOM 1019 C ALA A 66 -13.233 0.886 -10.203 1.00 0.00 C ATOM 1020 O ALA A 66 -12.285 1.642 -9.993 1.00 0.00 O ATOM 1021 CB ALA A 66 -13.990 -1.262 -9.168 1.00 0.00 C ATOM 0 H ALA A 66 -11.287 -0.520 -9.039 1.00 0.00 H new ATOM 0 HA ALA A 66 -13.277 -1.012 -11.171 1.00 0.00 H new ATOM 0 HB1 ALA A 66 -15.017 -0.991 -9.411 1.00 0.00 H new ATOM 0 HB2 ALA A 66 -13.883 -2.346 -9.201 1.00 0.00 H new ATOM 0 HB3 ALA A 66 -13.748 -0.904 -8.167 1.00 0.00 H new ATOM 1027 N ASN A 67 -14.462 1.320 -10.463 1.00 0.00 N ATOM 1028 CA ASN A 67 -14.773 2.744 -10.517 1.00 0.00 C ATOM 1029 C ASN A 67 -15.806 3.115 -9.458 1.00 0.00 C ATOM 1030 O ASN A 67 -15.668 4.125 -8.769 1.00 0.00 O ATOM 1031 CB ASN A 67 -15.292 3.121 -11.906 1.00 0.00 C ATOM 1032 CG ASN A 67 -14.302 2.783 -13.005 1.00 0.00 C ATOM 1033 OD1 ASN A 67 -13.568 3.649 -13.482 1.00 0.00 O ATOM 1034 ND2 ASN A 67 -14.278 1.519 -13.411 1.00 0.00 N ATOM 0 H ASN A 67 -15.258 0.707 -10.639 1.00 0.00 H new ATOM 0 HA ASN A 67 -13.857 3.299 -10.316 1.00 0.00 H new ATOM 0 HB2 ASN A 67 -16.231 2.600 -12.094 1.00 0.00 H new ATOM 0 HB3 ASN A 67 -15.509 4.189 -11.932 1.00 0.00 H new ATOM 0 HD21 ASN A 67 -13.633 1.232 -14.147 1.00 0.00 H new ATOM 0 HD22 ASN A 67 -14.905 0.835 -12.987 1.00 0.00 H new ATOM 1041 N SER A 68 -16.842 2.291 -9.335 1.00 0.00 N ATOM 1042 CA SER A 68 -17.901 2.534 -8.362 1.00 0.00 C ATOM 1043 C SER A 68 -17.328 2.646 -6.952 1.00 0.00 C ATOM 1044 O SER A 68 -16.575 1.780 -6.505 1.00 0.00 O ATOM 1045 CB SER A 68 -18.939 1.412 -8.416 1.00 0.00 C ATOM 1046 OG SER A 68 -20.114 1.770 -7.709 1.00 0.00 O ATOM 0 H SER A 68 -16.971 1.449 -9.897 1.00 0.00 H new ATOM 0 HA SER A 68 -18.384 3.478 -8.615 1.00 0.00 H new ATOM 0 HB2 SER A 68 -19.188 1.192 -9.454 1.00 0.00 H new ATOM 0 HB3 SER A 68 -18.518 0.502 -7.990 1.00 0.00 H new ATOM 0 HG SER A 68 -20.763 1.037 -7.760 1.00 0.00 H new ATOM 1052 N LEU A 69 -17.691 3.718 -6.257 1.00 0.00 N ATOM 1053 CA LEU A 69 -17.214 3.945 -4.897 1.00 0.00 C ATOM 1054 C LEU A 69 -17.480 2.728 -4.017 1.00 0.00 C ATOM 1055 O LEU A 69 -16.611 2.297 -3.260 1.00 0.00 O ATOM 1056 CB LEU A 69 -17.890 5.180 -4.298 1.00 0.00 C ATOM 1057 CG LEU A 69 -17.273 5.723 -3.009 1.00 0.00 C ATOM 1058 CD1 LEU A 69 -16.023 6.533 -3.316 1.00 0.00 C ATOM 1059 CD2 LEU A 69 -18.284 6.569 -2.248 1.00 0.00 C ATOM 0 H LEU A 69 -18.314 4.444 -6.612 1.00 0.00 H new ATOM 0 HA LEU A 69 -16.138 4.112 -4.938 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -17.879 5.974 -5.045 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -18.935 4.939 -4.104 1.00 0.00 H new ATOM 0 HG LEU A 69 -16.990 4.878 -2.381 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -15.597 6.912 -2.387 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -15.292 5.898 -3.818 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -16.282 7.370 -3.964 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -17.827 6.947 -1.333 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -18.598 7.407 -2.870 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -19.152 5.959 -1.995 1.00 0.00 H new ATOM 1071 N GLN A 70 -18.685 2.179 -4.124 1.00 0.00 N ATOM 1072 CA GLN A 70 -19.064 1.010 -3.338 1.00 0.00 C ATOM 1073 C GLN A 70 -17.908 0.021 -3.242 1.00 0.00 C ATOM 1074 O GLN A 70 -17.557 -0.433 -2.153 1.00 0.00 O ATOM 1075 CB GLN A 70 -20.286 0.328 -3.957 1.00 0.00 C ATOM 1076 CG GLN A 70 -20.832 -0.817 -3.119 1.00 0.00 C ATOM 1077 CD GLN A 70 -21.311 -0.364 -1.754 1.00 0.00 C ATOM 1078 OE1 GLN A 70 -20.719 -0.710 -0.730 1.00 0.00 O ATOM 1079 NE2 GLN A 70 -22.386 0.414 -1.731 1.00 0.00 N ATOM 0 H GLN A 70 -19.416 2.524 -4.747 1.00 0.00 H new ATOM 0 HA GLN A 70 -19.315 1.345 -2.332 1.00 0.00 H new ATOM 0 HB2 GLN A 70 -21.072 1.069 -4.100 1.00 0.00 H new ATOM 0 HB3 GLN A 70 -20.020 -0.050 -4.944 1.00 0.00 H new ATOM 0 HG2 GLN A 70 -21.657 -1.290 -3.651 1.00 0.00 H new ATOM 0 HG3 GLN A 70 -20.057 -1.574 -2.995 1.00 0.00 H new ATOM 0 HE21 GLN A 70 -22.845 0.676 -2.604 1.00 0.00 H new ATOM 0 HE22 GLN A 70 -22.753 0.750 -0.841 1.00 0.00 H new ATOM 1088 N GLN A 71 -17.322 -0.310 -4.388 1.00 0.00 N ATOM 1089 CA GLN A 71 -16.205 -1.247 -4.432 1.00 0.00 C ATOM 1090 C GLN A 71 -15.008 -0.704 -3.660 1.00 0.00 C ATOM 1091 O GLN A 71 -14.400 -1.411 -2.856 1.00 0.00 O ATOM 1092 CB GLN A 71 -15.807 -1.531 -5.881 1.00 0.00 C ATOM 1093 CG GLN A 71 -14.939 -2.768 -6.042 1.00 0.00 C ATOM 1094 CD GLN A 71 -15.681 -4.049 -5.717 1.00 0.00 C ATOM 1095 OE1 GLN A 71 -16.828 -4.236 -6.126 1.00 0.00 O ATOM 1096 NE2 GLN A 71 -15.031 -4.939 -4.977 1.00 0.00 N ATOM 0 H GLN A 71 -17.602 0.056 -5.298 1.00 0.00 H new ATOM 0 HA GLN A 71 -16.525 -2.177 -3.962 1.00 0.00 H new ATOM 0 HB2 GLN A 71 -16.710 -1.650 -6.480 1.00 0.00 H new ATOM 0 HB3 GLN A 71 -15.272 -0.668 -6.278 1.00 0.00 H new ATOM 0 HG2 GLN A 71 -14.569 -2.817 -7.066 1.00 0.00 H new ATOM 0 HG3 GLN A 71 -14.068 -2.683 -5.393 1.00 0.00 H new ATOM 0 HE21 GLN A 71 -14.082 -4.743 -4.660 1.00 0.00 H new ATOM 0 HE22 GLN A 71 -15.481 -5.819 -4.726 1.00 0.00 H new ATOM 1105 N LYS A 72 -14.672 0.558 -3.910 1.00 0.00 N ATOM 1106 CA LYS A 72 -13.547 1.198 -3.238 1.00 0.00 C ATOM 1107 C LYS A 72 -13.448 0.741 -1.786 1.00 0.00 C ATOM 1108 O LYS A 72 -12.461 0.125 -1.384 1.00 0.00 O ATOM 1109 CB LYS A 72 -13.691 2.720 -3.296 1.00 0.00 C ATOM 1110 CG LYS A 72 -13.793 3.268 -4.709 1.00 0.00 C ATOM 1111 CD LYS A 72 -12.484 3.111 -5.465 1.00 0.00 C ATOM 1112 CE LYS A 72 -12.713 3.029 -6.966 1.00 0.00 C ATOM 1113 NZ LYS A 72 -13.293 1.718 -7.368 1.00 0.00 N ATOM 0 H LYS A 72 -15.163 1.157 -4.573 1.00 0.00 H new ATOM 0 HA LYS A 72 -12.633 0.905 -3.755 1.00 0.00 H new ATOM 0 HB2 LYS A 72 -14.579 3.014 -2.736 1.00 0.00 H new ATOM 0 HB3 LYS A 72 -12.835 3.177 -2.799 1.00 0.00 H new ATOM 0 HG2 LYS A 72 -14.588 2.749 -5.245 1.00 0.00 H new ATOM 0 HG3 LYS A 72 -14.069 4.322 -4.672 1.00 0.00 H new ATOM 0 HD2 LYS A 72 -11.830 3.954 -5.241 1.00 0.00 H new ATOM 0 HD3 LYS A 72 -11.972 2.211 -5.124 1.00 0.00 H new ATOM 0 HE2 LYS A 72 -13.382 3.832 -7.276 1.00 0.00 H new ATOM 0 HE3 LYS A 72 -11.768 3.183 -7.486 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 -12.571 1.156 -7.863 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 -13.610 1.205 -6.521 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 -14.103 1.876 -8.001 1.00 0.00 H new ATOM 1127 N LEU A 73 -14.478 1.046 -1.004 1.00 0.00 N ATOM 1128 CA LEU A 73 -14.508 0.665 0.404 1.00 0.00 C ATOM 1129 C LEU A 73 -14.296 -0.837 0.566 1.00 0.00 C ATOM 1130 O LEU A 73 -13.502 -1.276 1.398 1.00 0.00 O ATOM 1131 CB LEU A 73 -15.840 1.075 1.035 1.00 0.00 C ATOM 1132 CG LEU A 73 -15.911 2.498 1.588 1.00 0.00 C ATOM 1133 CD1 LEU A 73 -17.312 2.807 2.091 1.00 0.00 C ATOM 1134 CD2 LEU A 73 -14.889 2.690 2.700 1.00 0.00 C ATOM 0 H LEU A 73 -15.303 1.556 -1.321 1.00 0.00 H new ATOM 0 HA LEU A 73 -13.697 1.185 0.913 1.00 0.00 H new ATOM 0 HB2 LEU A 73 -16.625 0.958 0.287 1.00 0.00 H new ATOM 0 HB3 LEU A 73 -16.065 0.380 1.845 1.00 0.00 H new ATOM 0 HG LEU A 73 -15.676 3.192 0.781 1.00 0.00 H new ATOM 0 HD11 LEU A 73 -17.342 3.824 2.481 1.00 0.00 H new ATOM 0 HD12 LEU A 73 -18.023 2.712 1.270 1.00 0.00 H new ATOM 0 HD13 LEU A 73 -17.577 2.107 2.883 1.00 0.00 H new ATOM 0 HD21 LEU A 73 -14.954 3.709 3.082 1.00 0.00 H new ATOM 0 HD22 LEU A 73 -15.093 1.986 3.507 1.00 0.00 H new ATOM 0 HD23 LEU A 73 -13.887 2.512 2.308 1.00 0.00 H new ATOM 1146 N SER A 74 -15.011 -1.621 -0.235 1.00 0.00 N ATOM 1147 CA SER A 74 -14.902 -3.074 -0.179 1.00 0.00 C ATOM 1148 C SER A 74 -13.442 -3.512 -0.230 1.00 0.00 C ATOM 1149 O SER A 74 -12.945 -4.161 0.689 1.00 0.00 O ATOM 1150 CB SER A 74 -15.678 -3.709 -1.335 1.00 0.00 C ATOM 1151 OG SER A 74 -15.626 -5.123 -1.268 1.00 0.00 O ATOM 0 H SER A 74 -15.672 -1.274 -0.930 1.00 0.00 H new ATOM 0 HA SER A 74 -15.331 -3.410 0.765 1.00 0.00 H new ATOM 0 HB2 SER A 74 -16.716 -3.378 -1.305 1.00 0.00 H new ATOM 0 HB3 SER A 74 -15.263 -3.371 -2.285 1.00 0.00 H new ATOM 0 HG SER A 74 -16.131 -5.505 -2.016 1.00 0.00 H new ATOM 1157 N ASN A 75 -12.760 -3.151 -1.312 1.00 0.00 N ATOM 1158 CA ASN A 75 -11.356 -3.507 -1.485 1.00 0.00 C ATOM 1159 C ASN A 75 -10.552 -3.169 -0.233 1.00 0.00 C ATOM 1160 O ASN A 75 -10.047 -4.059 0.451 1.00 0.00 O ATOM 1161 CB ASN A 75 -10.768 -2.778 -2.695 1.00 0.00 C ATOM 1162 CG ASN A 75 -11.277 -3.336 -4.010 1.00 0.00 C ATOM 1163 OD1 ASN A 75 -11.998 -4.333 -4.036 1.00 0.00 O ATOM 1164 ND2 ASN A 75 -10.902 -2.694 -5.110 1.00 0.00 N ATOM 0 H ASN A 75 -13.156 -2.612 -2.082 1.00 0.00 H new ATOM 0 HA ASN A 75 -11.297 -4.582 -1.654 1.00 0.00 H new ATOM 0 HB2 ASN A 75 -11.016 -1.718 -2.633 1.00 0.00 H new ATOM 0 HB3 ASN A 75 -9.681 -2.853 -2.668 1.00 0.00 H new ATOM 0 HD21 ASN A 75 -11.213 -3.024 -6.024 1.00 0.00 H new ATOM 0 HD22 ASN A 75 -10.303 -1.871 -5.041 1.00 0.00 H new ATOM 1171 N TRP A 76 -10.437 -1.879 0.059 1.00 0.00 N ATOM 1172 CA TRP A 76 -9.695 -1.423 1.229 1.00 0.00 C ATOM 1173 C TRP A 76 -9.948 -2.336 2.424 1.00 0.00 C ATOM 1174 O TRP A 76 -9.012 -2.864 3.023 1.00 0.00 O ATOM 1175 CB TRP A 76 -10.084 0.014 1.578 1.00 0.00 C ATOM 1176 CG TRP A 76 -9.240 1.042 0.887 1.00 0.00 C ATOM 1177 CD1 TRP A 76 -9.564 1.748 -0.236 1.00 0.00 C ATOM 1178 CD2 TRP A 76 -7.932 1.478 1.273 1.00 0.00 C ATOM 1179 NE1 TRP A 76 -8.537 2.596 -0.571 1.00 0.00 N ATOM 1180 CE2 TRP A 76 -7.524 2.451 0.340 1.00 0.00 C ATOM 1181 CE3 TRP A 76 -7.067 1.143 2.318 1.00 0.00 C ATOM 1182 CZ2 TRP A 76 -6.289 3.088 0.421 1.00 0.00 C ATOM 1183 CZ3 TRP A 76 -5.842 1.777 2.398 1.00 0.00 C ATOM 1184 CH2 TRP A 76 -5.462 2.741 1.454 1.00 0.00 C ATOM 0 H TRP A 76 -10.848 -1.130 -0.498 1.00 0.00 H new ATOM 0 HA TRP A 76 -8.632 -1.456 0.989 1.00 0.00 H new ATOM 0 HB2 TRP A 76 -11.129 0.175 1.313 1.00 0.00 H new ATOM 0 HB3 TRP A 76 -10.003 0.153 2.656 1.00 0.00 H new ATOM 0 HD1 TRP A 76 -10.492 1.653 -0.781 1.00 0.00 H new ATOM 0 HE1 TRP A 76 -8.530 3.231 -1.369 1.00 0.00 H new ATOM 0 HE3 TRP A 76 -7.351 0.402 3.050 1.00 0.00 H new ATOM 0 HZ2 TRP A 76 -5.994 3.830 -0.306 1.00 0.00 H new ATOM 0 HZ3 TRP A 76 -5.166 1.526 3.202 1.00 0.00 H new ATOM 0 HH2 TRP A 76 -4.498 3.219 1.544 1.00 0.00 H new ATOM 1195 N GLY A 77 -11.220 -2.518 2.765 1.00 0.00 N ATOM 1196 CA GLY A 77 -11.572 -3.368 3.887 1.00 0.00 C ATOM 1197 C GLY A 77 -10.701 -4.606 3.974 1.00 0.00 C ATOM 1198 O GLY A 77 -10.004 -4.815 4.967 1.00 0.00 O ATOM 0 H GLY A 77 -12.013 -2.092 2.284 1.00 0.00 H new ATOM 0 HA2 GLY A 77 -11.482 -2.799 4.812 1.00 0.00 H new ATOM 0 HA3 GLY A 77 -12.616 -3.668 3.798 1.00 0.00 H new ATOM 1202 N HIS A 78 -10.741 -5.430 2.931 1.00 0.00 N ATOM 1203 CA HIS A 78 -9.949 -6.654 2.894 1.00 0.00 C ATOM 1204 C HIS A 78 -8.474 -6.355 3.142 1.00 0.00 C ATOM 1205 O HIS A 78 -7.772 -7.133 3.790 1.00 0.00 O ATOM 1206 CB HIS A 78 -10.120 -7.356 1.547 1.00 0.00 C ATOM 1207 CG HIS A 78 -11.479 -7.954 1.351 1.00 0.00 C ATOM 1208 ND1 HIS A 78 -11.678 -9.230 0.869 1.00 0.00 N ATOM 1209 CD2 HIS A 78 -12.712 -7.443 1.577 1.00 0.00 C ATOM 1210 CE1 HIS A 78 -12.974 -9.478 0.805 1.00 0.00 C ATOM 1211 NE2 HIS A 78 -13.624 -8.409 1.230 1.00 0.00 N ATOM 0 H HIS A 78 -11.313 -5.272 2.101 1.00 0.00 H new ATOM 0 HA HIS A 78 -10.306 -7.312 3.686 1.00 0.00 H new ATOM 0 HB2 HIS A 78 -9.928 -6.641 0.747 1.00 0.00 H new ATOM 0 HB3 HIS A 78 -9.370 -8.142 1.459 1.00 0.00 H new ATOM 0 HD2 HIS A 78 -12.937 -6.458 1.959 1.00 0.00 H new ATOM 0 HE1 HIS A 78 -13.425 -10.398 0.463 1.00 0.00 H new ATOM 0 HE2 HIS A 78 -14.638 -8.316 1.290 1.00 0.00 H new ATOM 1220 N LEU A 79 -8.009 -5.224 2.621 1.00 0.00 N ATOM 1221 CA LEU A 79 -6.616 -4.822 2.785 1.00 0.00 C ATOM 1222 C LEU A 79 -6.277 -4.621 4.259 1.00 0.00 C ATOM 1223 O LEU A 79 -5.111 -4.657 4.648 1.00 0.00 O ATOM 1224 CB LEU A 79 -6.342 -3.535 2.006 1.00 0.00 C ATOM 1225 CG LEU A 79 -4.890 -3.300 1.587 1.00 0.00 C ATOM 1226 CD1 LEU A 79 -4.609 -3.957 0.244 1.00 0.00 C ATOM 1227 CD2 LEU A 79 -4.585 -1.811 1.529 1.00 0.00 C ATOM 0 H LEU A 79 -8.576 -4.570 2.082 1.00 0.00 H new ATOM 0 HA LEU A 79 -5.984 -5.619 2.392 1.00 0.00 H new ATOM 0 HB2 LEU A 79 -6.962 -3.538 1.109 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -6.665 -2.690 2.614 1.00 0.00 H new ATOM 0 HG LEU A 79 -4.239 -3.754 2.334 1.00 0.00 H new ATOM 0 HD11 LEU A 79 -3.571 -3.779 -0.038 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -4.786 -5.030 0.320 1.00 0.00 H new ATOM 0 HD13 LEU A 79 -5.268 -3.533 -0.513 1.00 0.00 H new ATOM 0 HD21 LEU A 79 -3.547 -1.664 1.229 1.00 0.00 H new ATOM 0 HD22 LEU A 79 -5.244 -1.333 0.804 1.00 0.00 H new ATOM 0 HD23 LEU A 79 -4.745 -1.368 2.512 1.00 0.00 H new ATOM 1239 N ASN A 80 -7.306 -4.410 5.074 1.00 0.00 N ATOM 1240 CA ASN A 80 -7.117 -4.204 6.505 1.00 0.00 C ATOM 1241 C ASN A 80 -6.912 -5.535 7.223 1.00 0.00 C ATOM 1242 O ASN A 80 -6.244 -5.598 8.256 1.00 0.00 O ATOM 1243 CB ASN A 80 -8.322 -3.472 7.099 1.00 0.00 C ATOM 1244 CG ASN A 80 -8.105 -3.085 8.550 1.00 0.00 C ATOM 1245 OD1 ASN A 80 -7.161 -3.545 9.192 1.00 0.00 O ATOM 1246 ND2 ASN A 80 -8.982 -2.236 9.073 1.00 0.00 N ATOM 0 H ASN A 80 -8.278 -4.377 4.768 1.00 0.00 H new ATOM 0 HA ASN A 80 -6.224 -3.594 6.645 1.00 0.00 H new ATOM 0 HB2 ASN A 80 -8.524 -2.576 6.513 1.00 0.00 H new ATOM 0 HB3 ASN A 80 -9.204 -4.108 7.023 1.00 0.00 H new ATOM 0 HD21 ASN A 80 -8.888 -1.940 10.045 1.00 0.00 H new ATOM 0 HD22 ASN A 80 -9.749 -1.880 8.503 1.00 0.00 H new ATOM 1253 N ARG A 81 -7.490 -6.595 6.669 1.00 0.00 N ATOM 1254 CA ARG A 81 -7.371 -7.924 7.257 1.00 0.00 C ATOM 1255 C ARG A 81 -6.500 -8.827 6.387 1.00 0.00 C ATOM 1256 O ARG A 81 -6.305 -10.003 6.695 1.00 0.00 O ATOM 1257 CB ARG A 81 -8.754 -8.552 7.436 1.00 0.00 C ATOM 1258 CG ARG A 81 -9.611 -7.849 8.476 1.00 0.00 C ATOM 1259 CD ARG A 81 -10.574 -8.814 9.149 1.00 0.00 C ATOM 1260 NE ARG A 81 -11.796 -8.148 9.594 1.00 0.00 N ATOM 1261 CZ ARG A 81 -12.743 -7.721 8.766 1.00 0.00 C ATOM 1262 NH1 ARG A 81 -12.610 -7.890 7.457 1.00 0.00 N ATOM 1263 NH2 ARG A 81 -13.826 -7.124 9.246 1.00 0.00 N ATOM 0 H ARG A 81 -8.045 -6.560 5.814 1.00 0.00 H new ATOM 0 HA ARG A 81 -6.897 -7.821 8.233 1.00 0.00 H new ATOM 0 HB2 ARG A 81 -9.276 -8.540 6.479 1.00 0.00 H new ATOM 0 HB3 ARG A 81 -8.635 -9.597 7.721 1.00 0.00 H new ATOM 0 HG2 ARG A 81 -8.969 -7.390 9.228 1.00 0.00 H new ATOM 0 HG3 ARG A 81 -10.173 -7.044 8.002 1.00 0.00 H new ATOM 0 HD2 ARG A 81 -10.830 -9.614 8.454 1.00 0.00 H new ATOM 0 HD3 ARG A 81 -10.083 -9.279 10.004 1.00 0.00 H new ATOM 0 HE ARG A 81 -11.929 -8.003 10.595 1.00 0.00 H new ATOM 0 HH11 ARG A 81 -11.779 -8.349 7.084 1.00 0.00 H new ATOM 0 HH12 ARG A 81 -13.339 -7.561 6.824 1.00 0.00 H new ATOM 0 HH21 ARG A 81 -13.932 -6.992 10.252 1.00 0.00 H new ATOM 0 HH22 ARG A 81 -14.552 -6.797 8.609 1.00 0.00 H new ATOM 1277 N LYS A 82 -5.979 -8.269 5.300 1.00 0.00 N ATOM 1278 CA LYS A 82 -5.129 -9.022 4.386 1.00 0.00 C ATOM 1279 C LYS A 82 -3.690 -8.519 4.442 1.00 0.00 C ATOM 1280 O LYS A 82 -2.744 -9.299 4.332 1.00 0.00 O ATOM 1281 CB LYS A 82 -5.662 -8.914 2.955 1.00 0.00 C ATOM 1282 CG LYS A 82 -6.895 -9.763 2.700 1.00 0.00 C ATOM 1283 CD LYS A 82 -6.527 -11.125 2.134 1.00 0.00 C ATOM 1284 CE LYS A 82 -6.358 -12.159 3.236 1.00 0.00 C ATOM 1285 NZ LYS A 82 -7.620 -12.366 4.000 1.00 0.00 N ATOM 0 H LYS A 82 -6.131 -7.297 5.030 1.00 0.00 H new ATOM 0 HA LYS A 82 -5.143 -10.067 4.695 1.00 0.00 H new ATOM 0 HB2 LYS A 82 -5.899 -7.872 2.742 1.00 0.00 H new ATOM 0 HB3 LYS A 82 -4.876 -9.211 2.260 1.00 0.00 H new ATOM 0 HG2 LYS A 82 -7.448 -9.892 3.630 1.00 0.00 H new ATOM 0 HG3 LYS A 82 -7.557 -9.246 2.005 1.00 0.00 H new ATOM 0 HD2 LYS A 82 -7.302 -11.454 1.441 1.00 0.00 H new ATOM 0 HD3 LYS A 82 -5.602 -11.045 1.563 1.00 0.00 H new ATOM 0 HE2 LYS A 82 -6.038 -13.105 2.800 1.00 0.00 H new ATOM 0 HE3 LYS A 82 -5.569 -11.839 3.917 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 -7.655 -13.343 4.354 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 -7.652 -11.706 4.803 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 -8.435 -12.194 3.377 1.00 0.00 H new ATOM 1299 N VAL A 83 -3.531 -7.211 4.616 1.00 0.00 N ATOM 1300 CA VAL A 83 -2.207 -6.604 4.691 1.00 0.00 C ATOM 1301 C VAL A 83 -1.928 -6.064 6.089 1.00 0.00 C ATOM 1302 O VAL A 83 -1.124 -6.626 6.834 1.00 0.00 O ATOM 1303 CB VAL A 83 -2.056 -5.460 3.671 1.00 0.00 C ATOM 1304 CG1 VAL A 83 -0.711 -4.769 3.838 1.00 0.00 C ATOM 1305 CG2 VAL A 83 -2.222 -5.985 2.253 1.00 0.00 C ATOM 0 H VAL A 83 -4.303 -6.551 4.708 1.00 0.00 H new ATOM 0 HA VAL A 83 -1.486 -7.387 4.457 1.00 0.00 H new ATOM 0 HB VAL A 83 -2.840 -4.726 3.856 1.00 0.00 H new ATOM 0 HG11 VAL A 83 -0.623 -3.964 3.109 1.00 0.00 H new ATOM 0 HG12 VAL A 83 -0.636 -4.357 4.844 1.00 0.00 H new ATOM 0 HG13 VAL A 83 0.091 -5.490 3.681 1.00 0.00 H new ATOM 0 HG21 VAL A 83 -2.112 -5.163 1.546 1.00 0.00 H new ATOM 0 HG22 VAL A 83 -1.461 -6.740 2.053 1.00 0.00 H new ATOM 0 HG23 VAL A 83 -3.211 -6.429 2.143 1.00 0.00 H new ATOM 1315 N LEU A 84 -2.596 -4.972 6.439 1.00 0.00 N ATOM 1316 CA LEU A 84 -2.421 -4.355 7.750 1.00 0.00 C ATOM 1317 C LEU A 84 -2.182 -5.413 8.822 1.00 0.00 C ATOM 1318 O LEU A 84 -1.161 -5.396 9.510 1.00 0.00 O ATOM 1319 CB LEU A 84 -3.649 -3.516 8.109 1.00 0.00 C ATOM 1320 CG LEU A 84 -4.008 -2.398 7.130 1.00 0.00 C ATOM 1321 CD1 LEU A 84 -5.110 -1.520 7.703 1.00 0.00 C ATOM 1322 CD2 LEU A 84 -2.779 -1.565 6.797 1.00 0.00 C ATOM 0 H LEU A 84 -3.264 -4.495 5.834 1.00 0.00 H new ATOM 0 HA LEU A 84 -1.546 -3.706 7.705 1.00 0.00 H new ATOM 0 HB2 LEU A 84 -4.506 -4.183 8.198 1.00 0.00 H new ATOM 0 HB3 LEU A 84 -3.487 -3.073 9.092 1.00 0.00 H new ATOM 0 HG LEU A 84 -4.375 -2.852 6.209 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -5.352 -0.730 6.992 1.00 0.00 H new ATOM 0 HD12 LEU A 84 -5.997 -2.125 7.889 1.00 0.00 H new ATOM 0 HD13 LEU A 84 -4.771 -1.075 8.639 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -3.054 -0.774 6.099 1.00 0.00 H new ATOM 0 HD22 LEU A 84 -2.382 -1.121 7.710 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -2.020 -2.202 6.343 1.00 0.00 H new ATOM 1334 N LYS A 85 -3.129 -6.334 8.958 1.00 0.00 N ATOM 1335 CA LYS A 85 -3.021 -7.403 9.944 1.00 0.00 C ATOM 1336 C LYS A 85 -1.575 -7.863 10.092 1.00 0.00 C ATOM 1337 O LYS A 85 -1.011 -7.826 11.185 1.00 0.00 O ATOM 1338 CB LYS A 85 -3.905 -8.587 9.542 1.00 0.00 C ATOM 1339 CG LYS A 85 -4.186 -9.551 10.681 1.00 0.00 C ATOM 1340 CD LYS A 85 -5.249 -9.009 11.622 1.00 0.00 C ATOM 1341 CE LYS A 85 -6.650 -9.309 11.111 1.00 0.00 C ATOM 1342 NZ LYS A 85 -7.699 -8.767 12.018 1.00 0.00 N ATOM 0 H LYS A 85 -3.981 -6.362 8.398 1.00 0.00 H new ATOM 0 HA LYS A 85 -3.360 -7.013 10.904 1.00 0.00 H new ATOM 0 HB2 LYS A 85 -4.851 -8.208 9.156 1.00 0.00 H new ATOM 0 HB3 LYS A 85 -3.423 -9.130 8.729 1.00 0.00 H new ATOM 0 HG2 LYS A 85 -4.512 -10.509 10.276 1.00 0.00 H new ATOM 0 HG3 LYS A 85 -3.267 -9.736 11.237 1.00 0.00 H new ATOM 0 HD2 LYS A 85 -5.119 -9.448 12.611 1.00 0.00 H new ATOM 0 HD3 LYS A 85 -5.124 -7.932 11.733 1.00 0.00 H new ATOM 0 HE2 LYS A 85 -6.773 -8.881 10.116 1.00 0.00 H new ATOM 0 HE3 LYS A 85 -6.777 -10.387 11.012 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 -8.639 -8.992 11.635 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 -7.598 -9.195 12.961 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 -7.594 -7.735 12.093 1.00 0.00 H new ATOM 1356 N ARG A 86 -0.979 -8.295 8.984 1.00 0.00 N ATOM 1357 CA ARG A 86 0.402 -8.761 8.992 1.00 0.00 C ATOM 1358 C ARG A 86 1.323 -7.724 9.627 1.00 0.00 C ATOM 1359 O ARG A 86 2.184 -8.058 10.442 1.00 0.00 O ATOM 1360 CB ARG A 86 0.867 -9.067 7.567 1.00 0.00 C ATOM 1361 CG ARG A 86 -0.035 -10.041 6.827 1.00 0.00 C ATOM 1362 CD ARG A 86 0.221 -11.476 7.261 1.00 0.00 C ATOM 1363 NE ARG A 86 -0.082 -12.431 6.199 1.00 0.00 N ATOM 1364 CZ ARG A 86 -0.067 -13.749 6.369 1.00 0.00 C ATOM 1365 NH1 ARG A 86 0.234 -14.264 7.552 1.00 0.00 N ATOM 1366 NH2 ARG A 86 -0.354 -14.553 5.353 1.00 0.00 N ATOM 0 H ARG A 86 -1.431 -8.332 8.071 1.00 0.00 H new ATOM 0 HA ARG A 86 0.447 -9.674 9.586 1.00 0.00 H new ATOM 0 HB2 ARG A 86 0.921 -8.135 7.004 1.00 0.00 H new ATOM 0 HB3 ARG A 86 1.877 -9.476 7.603 1.00 0.00 H new ATOM 0 HG2 ARG A 86 -1.078 -9.784 7.011 1.00 0.00 H new ATOM 0 HG3 ARG A 86 0.131 -9.949 5.754 1.00 0.00 H new ATOM 0 HD2 ARG A 86 1.264 -11.584 7.559 1.00 0.00 H new ATOM 0 HD3 ARG A 86 -0.386 -11.704 8.137 1.00 0.00 H new ATOM 0 HE ARG A 86 -0.318 -12.067 5.276 1.00 0.00 H new ATOM 0 HH11 ARG A 86 0.455 -13.649 8.335 1.00 0.00 H new ATOM 0 HH12 ARG A 86 0.245 -15.276 7.680 1.00 0.00 H new ATOM 0 HH21 ARG A 86 -0.586 -14.159 4.441 1.00 0.00 H new ATOM 0 HH22 ARG A 86 -0.342 -15.564 5.484 1.00 0.00 H new ATOM 1380 N LEU A 87 1.136 -6.464 9.250 1.00 0.00 N ATOM 1381 CA LEU A 87 1.950 -5.377 9.782 1.00 0.00 C ATOM 1382 C LEU A 87 1.367 -4.851 11.090 1.00 0.00 C ATOM 1383 O LEU A 87 1.490 -3.668 11.404 1.00 0.00 O ATOM 1384 CB LEU A 87 2.049 -4.241 8.762 1.00 0.00 C ATOM 1385 CG LEU A 87 2.819 -4.557 7.479 1.00 0.00 C ATOM 1386 CD1 LEU A 87 2.281 -3.736 6.318 1.00 0.00 C ATOM 1387 CD2 LEU A 87 4.307 -4.300 7.673 1.00 0.00 C ATOM 0 H LEU A 87 0.428 -6.170 8.578 1.00 0.00 H new ATOM 0 HA LEU A 87 2.948 -5.767 9.980 1.00 0.00 H new ATOM 0 HB2 LEU A 87 1.039 -3.935 8.490 1.00 0.00 H new ATOM 0 HB3 LEU A 87 2.522 -3.386 9.245 1.00 0.00 H new ATOM 0 HG LEU A 87 2.681 -5.613 7.245 1.00 0.00 H new ATOM 0 HD11 LEU A 87 2.841 -3.974 5.414 1.00 0.00 H new ATOM 0 HD12 LEU A 87 1.227 -3.970 6.165 1.00 0.00 H new ATOM 0 HD13 LEU A 87 2.388 -2.675 6.542 1.00 0.00 H new ATOM 0 HD21 LEU A 87 4.839 -4.530 6.750 1.00 0.00 H new ATOM 0 HD22 LEU A 87 4.465 -3.253 7.931 1.00 0.00 H new ATOM 0 HD23 LEU A 87 4.684 -4.933 8.477 1.00 0.00 H new ATOM 1399 N ASN A 88 0.734 -5.739 11.850 1.00 0.00 N ATOM 1400 CA ASN A 88 0.135 -5.365 13.125 1.00 0.00 C ATOM 1401 C ASN A 88 -0.460 -3.961 13.056 1.00 0.00 C ATOM 1402 O ASN A 88 -0.370 -3.189 14.011 1.00 0.00 O ATOM 1403 CB ASN A 88 1.177 -5.435 14.243 1.00 0.00 C ATOM 1404 CG ASN A 88 1.973 -6.725 14.211 1.00 0.00 C ATOM 1405 OD1 ASN A 88 3.150 -6.733 13.851 1.00 0.00 O ATOM 1406 ND2 ASN A 88 1.332 -7.825 14.589 1.00 0.00 N ATOM 0 H ASN A 88 0.623 -6.723 11.604 1.00 0.00 H new ATOM 0 HA ASN A 88 -0.667 -6.070 13.341 1.00 0.00 H new ATOM 0 HB2 ASN A 88 1.858 -4.589 14.155 1.00 0.00 H new ATOM 0 HB3 ASN A 88 0.678 -5.343 15.208 1.00 0.00 H new ATOM 0 HD21 ASN A 88 1.816 -8.723 14.588 1.00 0.00 H new ATOM 0 HD22 ASN A 88 0.356 -7.772 14.880 1.00 0.00 H new ATOM 1413 N PHE A 89 -1.067 -3.638 11.919 1.00 0.00 N ATOM 1414 CA PHE A 89 -1.677 -2.327 11.724 1.00 0.00 C ATOM 1415 C PHE A 89 -3.199 -2.431 11.714 1.00 0.00 C ATOM 1416 O PHE A 89 -3.761 -3.433 11.272 1.00 0.00 O ATOM 1417 CB PHE A 89 -1.188 -1.704 10.415 1.00 0.00 C ATOM 1418 CG PHE A 89 -1.241 -0.203 10.409 1.00 0.00 C ATOM 1419 CD1 PHE A 89 -2.451 0.460 10.278 1.00 0.00 C ATOM 1420 CD2 PHE A 89 -0.082 0.545 10.534 1.00 0.00 C ATOM 1421 CE1 PHE A 89 -2.502 1.841 10.272 1.00 0.00 C ATOM 1422 CE2 PHE A 89 -0.127 1.926 10.529 1.00 0.00 C ATOM 1423 CZ PHE A 89 -1.339 2.575 10.399 1.00 0.00 C ATOM 0 H PHE A 89 -1.150 -4.265 11.119 1.00 0.00 H new ATOM 0 HA PHE A 89 -1.380 -1.688 12.556 1.00 0.00 H new ATOM 0 HB2 PHE A 89 -0.163 -2.024 10.230 1.00 0.00 H new ATOM 0 HB3 PHE A 89 -1.794 -2.084 9.592 1.00 0.00 H new ATOM 0 HD1 PHE A 89 -3.364 -0.109 10.180 1.00 0.00 H new ATOM 0 HD2 PHE A 89 0.869 0.043 10.637 1.00 0.00 H new ATOM 0 HE1 PHE A 89 -3.451 2.346 10.168 1.00 0.00 H new ATOM 0 HE2 PHE A 89 0.784 2.497 10.627 1.00 0.00 H new ATOM 0 HZ PHE A 89 -1.377 3.654 10.397 1.00 0.00 H new ATOM 1433 N SER A 90 -3.860 -1.388 12.206 1.00 0.00 N ATOM 1434 CA SER A 90 -5.317 -1.363 12.259 1.00 0.00 C ATOM 1435 C SER A 90 -5.852 0.005 11.844 1.00 0.00 C ATOM 1436 O SER A 90 -5.222 1.032 12.093 1.00 0.00 O ATOM 1437 CB SER A 90 -5.804 -1.707 13.668 1.00 0.00 C ATOM 1438 OG SER A 90 -5.339 -0.761 14.614 1.00 0.00 O ATOM 0 H SER A 90 -3.410 -0.550 12.573 1.00 0.00 H new ATOM 0 HA SER A 90 -5.694 -2.109 11.560 1.00 0.00 H new ATOM 0 HB2 SER A 90 -6.894 -1.735 13.683 1.00 0.00 H new ATOM 0 HB3 SER A 90 -5.456 -2.702 13.943 1.00 0.00 H new ATOM 0 HG SER A 90 -5.665 -1.003 15.506 1.00 0.00 H new ATOM 1444 N VAL A 91 -7.020 0.009 11.209 1.00 0.00 N ATOM 1445 CA VAL A 91 -7.642 1.249 10.760 1.00 0.00 C ATOM 1446 C VAL A 91 -9.162 1.139 10.778 1.00 0.00 C ATOM 1447 O VAL A 91 -9.747 0.183 10.266 1.00 0.00 O ATOM 1448 CB VAL A 91 -7.182 1.625 9.339 1.00 0.00 C ATOM 1449 CG1 VAL A 91 -8.151 2.612 8.708 1.00 0.00 C ATOM 1450 CG2 VAL A 91 -5.772 2.194 9.370 1.00 0.00 C ATOM 0 H VAL A 91 -7.554 -0.833 10.994 1.00 0.00 H new ATOM 0 HA VAL A 91 -7.329 2.029 11.454 1.00 0.00 H new ATOM 0 HB VAL A 91 -7.172 0.723 8.728 1.00 0.00 H new ATOM 0 HG11 VAL A 91 -7.810 2.866 7.704 1.00 0.00 H new ATOM 0 HG12 VAL A 91 -9.142 2.163 8.651 1.00 0.00 H new ATOM 0 HG13 VAL A 91 -8.197 3.516 9.315 1.00 0.00 H new ATOM 0 HG21 VAL A 91 -5.462 2.454 8.358 1.00 0.00 H new ATOM 0 HG22 VAL A 91 -5.753 3.086 9.996 1.00 0.00 H new ATOM 0 HG23 VAL A 91 -5.088 1.450 9.778 1.00 0.00 H new ATOM 1460 N PRO A 92 -9.821 2.140 11.381 1.00 0.00 N ATOM 1461 CA PRO A 92 -11.283 2.179 11.479 1.00 0.00 C ATOM 1462 C PRO A 92 -11.948 2.424 10.129 1.00 0.00 C ATOM 1463 O PRO A 92 -11.272 2.638 9.122 1.00 0.00 O ATOM 1464 CB PRO A 92 -11.544 3.355 12.424 1.00 0.00 C ATOM 1465 CG PRO A 92 -10.348 4.231 12.277 1.00 0.00 C ATOM 1466 CD PRO A 92 -9.189 3.310 12.013 1.00 0.00 C ATOM 0 HA PRO A 92 -11.693 1.232 11.831 1.00 0.00 H new ATOM 0 HB2 PRO A 92 -12.458 3.884 12.154 1.00 0.00 H new ATOM 0 HB3 PRO A 92 -11.663 3.017 13.453 1.00 0.00 H new ATOM 0 HG2 PRO A 92 -10.480 4.937 11.457 1.00 0.00 H new ATOM 0 HG3 PRO A 92 -10.182 4.819 13.180 1.00 0.00 H new ATOM 0 HD2 PRO A 92 -8.450 3.771 11.357 1.00 0.00 H new ATOM 0 HD3 PRO A 92 -8.673 3.039 12.934 1.00 0.00 H new ATOM 1474 N ASP A 93 -13.276 2.392 10.114 1.00 0.00 N ATOM 1475 CA ASP A 93 -14.033 2.612 8.887 1.00 0.00 C ATOM 1476 C ASP A 93 -14.038 4.090 8.510 1.00 0.00 C ATOM 1477 O ASP A 93 -13.802 4.447 7.355 1.00 0.00 O ATOM 1478 CB ASP A 93 -15.468 2.109 9.051 1.00 0.00 C ATOM 1479 CG ASP A 93 -15.601 0.628 8.754 1.00 0.00 C ATOM 1480 OD1 ASP A 93 -15.246 0.214 7.630 1.00 0.00 O ATOM 1481 OD2 ASP A 93 -16.057 -0.116 9.646 1.00 0.00 O ATOM 0 H ASP A 93 -13.851 2.216 10.938 1.00 0.00 H new ATOM 0 HA ASP A 93 -13.550 2.053 8.085 1.00 0.00 H new ATOM 0 HB2 ASP A 93 -15.804 2.304 10.070 1.00 0.00 H new ATOM 0 HB3 ASP A 93 -16.125 2.670 8.386 1.00 0.00 H new ATOM 1486 N ASP A 94 -14.310 4.944 9.490 1.00 0.00 N ATOM 1487 CA ASP A 94 -14.347 6.384 9.261 1.00 0.00 C ATOM 1488 C ASP A 94 -13.156 6.831 8.418 1.00 0.00 C ATOM 1489 O ASP A 94 -13.318 7.525 7.414 1.00 0.00 O ATOM 1490 CB ASP A 94 -14.354 7.134 10.594 1.00 0.00 C ATOM 1491 CG ASP A 94 -13.978 8.594 10.438 1.00 0.00 C ATOM 1492 OD1 ASP A 94 -12.804 8.875 10.119 1.00 0.00 O ATOM 1493 OD2 ASP A 94 -14.859 9.457 10.635 1.00 0.00 O ATOM 0 H ASP A 94 -14.508 4.665 10.451 1.00 0.00 H new ATOM 0 HA ASP A 94 -15.262 6.617 8.717 1.00 0.00 H new ATOM 0 HB2 ASP A 94 -15.345 7.063 11.043 1.00 0.00 H new ATOM 0 HB3 ASP A 94 -13.658 6.654 11.282 1.00 0.00 H new ATOM 1498 N VAL A 95 -11.959 6.429 8.834 1.00 0.00 N ATOM 1499 CA VAL A 95 -10.741 6.787 8.118 1.00 0.00 C ATOM 1500 C VAL A 95 -10.771 6.265 6.686 1.00 0.00 C ATOM 1501 O VAL A 95 -10.396 6.970 5.750 1.00 0.00 O ATOM 1502 CB VAL A 95 -9.490 6.235 8.827 1.00 0.00 C ATOM 1503 CG1 VAL A 95 -8.239 6.537 8.016 1.00 0.00 C ATOM 1504 CG2 VAL A 95 -9.377 6.810 10.231 1.00 0.00 C ATOM 0 H VAL A 95 -11.807 5.855 9.663 1.00 0.00 H new ATOM 0 HA VAL A 95 -10.691 7.876 8.104 1.00 0.00 H new ATOM 0 HB VAL A 95 -9.588 5.152 8.909 1.00 0.00 H new ATOM 0 HG11 VAL A 95 -7.366 6.139 8.533 1.00 0.00 H new ATOM 0 HG12 VAL A 95 -8.322 6.073 7.033 1.00 0.00 H new ATOM 0 HG13 VAL A 95 -8.132 7.616 7.900 1.00 0.00 H new ATOM 0 HG21 VAL A 95 -8.488 6.410 10.718 1.00 0.00 H new ATOM 0 HG22 VAL A 95 -9.302 7.896 10.174 1.00 0.00 H new ATOM 0 HG23 VAL A 95 -10.260 6.537 10.808 1.00 0.00 H new ATOM 1514 N MET A 96 -11.222 5.025 6.523 1.00 0.00 N ATOM 1515 CA MET A 96 -11.303 4.409 5.204 1.00 0.00 C ATOM 1516 C MET A 96 -12.251 5.189 4.297 1.00 0.00 C ATOM 1517 O MET A 96 -11.935 5.458 3.138 1.00 0.00 O ATOM 1518 CB MET A 96 -11.772 2.958 5.323 1.00 0.00 C ATOM 1519 CG MET A 96 -10.739 2.035 5.949 1.00 0.00 C ATOM 1520 SD MET A 96 -10.883 0.335 5.367 1.00 0.00 S ATOM 1521 CE MET A 96 -11.373 -0.499 6.875 1.00 0.00 C ATOM 0 H MET A 96 -11.537 4.428 7.288 1.00 0.00 H new ATOM 0 HA MET A 96 -10.307 4.426 4.761 1.00 0.00 H new ATOM 0 HB2 MET A 96 -12.684 2.927 5.920 1.00 0.00 H new ATOM 0 HB3 MET A 96 -12.027 2.585 4.331 1.00 0.00 H new ATOM 0 HG2 MET A 96 -9.740 2.409 5.724 1.00 0.00 H new ATOM 0 HG3 MET A 96 -10.850 2.054 7.033 1.00 0.00 H new ATOM 0 HE1 MET A 96 -11.228 -1.573 6.760 1.00 0.00 H new ATOM 0 HE2 MET A 96 -10.765 -0.138 7.705 1.00 0.00 H new ATOM 0 HE3 MET A 96 -12.424 -0.294 7.079 1.00 0.00 H new ATOM 1531 N ARG A 97 -13.413 5.548 4.833 1.00 0.00 N ATOM 1532 CA ARG A 97 -14.407 6.295 4.071 1.00 0.00 C ATOM 1533 C ARG A 97 -13.771 7.500 3.383 1.00 0.00 C ATOM 1534 O ARG A 97 -13.976 7.728 2.191 1.00 0.00 O ATOM 1535 CB ARG A 97 -15.541 6.757 4.987 1.00 0.00 C ATOM 1536 CG ARG A 97 -16.410 5.620 5.501 1.00 0.00 C ATOM 1537 CD ARG A 97 -17.482 6.126 6.454 1.00 0.00 C ATOM 1538 NE ARG A 97 -18.462 5.091 6.773 1.00 0.00 N ATOM 1539 CZ ARG A 97 -19.337 5.189 7.768 1.00 0.00 C ATOM 1540 NH1 ARG A 97 -19.353 6.270 8.536 1.00 0.00 N ATOM 1541 NH2 ARG A 97 -20.197 4.206 7.996 1.00 0.00 N ATOM 0 H ARG A 97 -13.689 5.334 5.791 1.00 0.00 H new ATOM 0 HA ARG A 97 -14.814 5.634 3.306 1.00 0.00 H new ATOM 0 HB2 ARG A 97 -15.116 7.291 5.837 1.00 0.00 H new ATOM 0 HB3 ARG A 97 -16.168 7.466 4.446 1.00 0.00 H new ATOM 0 HG2 ARG A 97 -16.880 5.111 4.660 1.00 0.00 H new ATOM 0 HG3 ARG A 97 -15.786 4.885 6.010 1.00 0.00 H new ATOM 0 HD2 ARG A 97 -17.013 6.478 7.373 1.00 0.00 H new ATOM 0 HD3 ARG A 97 -17.990 6.981 6.008 1.00 0.00 H new ATOM 0 HE ARG A 97 -18.475 4.247 6.201 1.00 0.00 H new ATOM 0 HH11 ARG A 97 -18.693 7.028 8.363 1.00 0.00 H new ATOM 0 HH12 ARG A 97 -20.026 6.343 9.299 1.00 0.00 H new ATOM 0 HH21 ARG A 97 -20.187 3.373 7.407 1.00 0.00 H new ATOM 0 HH22 ARG A 97 -20.868 4.283 8.760 1.00 0.00 H new ATOM 1555 N LYS A 98 -12.999 8.269 4.144 1.00 0.00 N ATOM 1556 CA LYS A 98 -12.333 9.451 3.609 1.00 0.00 C ATOM 1557 C LYS A 98 -11.443 9.085 2.426 1.00 0.00 C ATOM 1558 O LYS A 98 -11.593 9.630 1.332 1.00 0.00 O ATOM 1559 CB LYS A 98 -11.498 10.127 4.699 1.00 0.00 C ATOM 1560 CG LYS A 98 -12.322 10.632 5.871 1.00 0.00 C ATOM 1561 CD LYS A 98 -11.515 10.638 7.159 1.00 0.00 C ATOM 1562 CE LYS A 98 -10.754 11.943 7.334 1.00 0.00 C ATOM 1563 NZ LYS A 98 -10.052 12.004 8.646 1.00 0.00 N ATOM 0 H LYS A 98 -12.819 8.095 5.133 1.00 0.00 H new ATOM 0 HA LYS A 98 -13.099 10.145 3.263 1.00 0.00 H new ATOM 0 HB2 LYS A 98 -10.754 9.420 5.066 1.00 0.00 H new ATOM 0 HB3 LYS A 98 -10.953 10.964 4.261 1.00 0.00 H new ATOM 0 HG2 LYS A 98 -12.678 11.640 5.659 1.00 0.00 H new ATOM 0 HG3 LYS A 98 -13.203 10.002 5.996 1.00 0.00 H new ATOM 0 HD2 LYS A 98 -12.182 10.488 8.008 1.00 0.00 H new ATOM 0 HD3 LYS A 98 -10.813 9.804 7.154 1.00 0.00 H new ATOM 0 HE2 LYS A 98 -10.028 12.051 6.528 1.00 0.00 H new ATOM 0 HE3 LYS A 98 -11.446 12.781 7.253 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 -9.545 12.909 8.727 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 -10.747 11.927 9.416 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 -9.373 11.219 8.713 1.00 0.00 H new ATOM 1577 N ILE A 99 -10.517 8.159 2.652 1.00 0.00 N ATOM 1578 CA ILE A 99 -9.605 7.719 1.603 1.00 0.00 C ATOM 1579 C ILE A 99 -10.358 7.414 0.312 1.00 0.00 C ATOM 1580 O ILE A 99 -10.053 7.970 -0.742 1.00 0.00 O ATOM 1581 CB ILE A 99 -8.816 6.468 2.032 1.00 0.00 C ATOM 1582 CG1 ILE A 99 -8.016 6.754 3.304 1.00 0.00 C ATOM 1583 CG2 ILE A 99 -7.894 6.013 0.910 1.00 0.00 C ATOM 1584 CD1 ILE A 99 -7.709 5.515 4.116 1.00 0.00 C ATOM 0 H ILE A 99 -10.378 7.699 3.552 1.00 0.00 H new ATOM 0 HA ILE A 99 -8.906 8.537 1.428 1.00 0.00 H new ATOM 0 HB ILE A 99 -9.523 5.665 2.243 1.00 0.00 H new ATOM 0 HG12 ILE A 99 -7.080 7.242 3.033 1.00 0.00 H new ATOM 0 HG13 ILE A 99 -8.573 7.456 3.924 1.00 0.00 H new ATOM 0 HG21 ILE A 99 -7.343 5.128 1.228 1.00 0.00 H new ATOM 0 HG22 ILE A 99 -8.486 5.774 0.027 1.00 0.00 H new ATOM 0 HG23 ILE A 99 -7.191 6.811 0.670 1.00 0.00 H new ATOM 0 HD11 ILE A 99 -7.140 5.793 5.003 1.00 0.00 H new ATOM 0 HD12 ILE A 99 -8.641 5.038 4.418 1.00 0.00 H new ATOM 0 HD13 ILE A 99 -7.124 4.820 3.513 1.00 0.00 H new ATOM 1596 N ALA A 100 -11.344 6.528 0.404 1.00 0.00 N ATOM 1597 CA ALA A 100 -12.144 6.152 -0.755 1.00 0.00 C ATOM 1598 C ALA A 100 -12.841 7.366 -1.359 1.00 0.00 C ATOM 1599 O ALA A 100 -13.207 7.362 -2.534 1.00 0.00 O ATOM 1600 CB ALA A 100 -13.165 5.092 -0.370 1.00 0.00 C ATOM 0 H ALA A 100 -11.608 6.057 1.269 1.00 0.00 H new ATOM 0 HA ALA A 100 -11.474 5.739 -1.509 1.00 0.00 H new ATOM 0 HB1 ALA A 100 -13.755 4.821 -1.245 1.00 0.00 H new ATOM 0 HB2 ALA A 100 -12.649 4.209 0.007 1.00 0.00 H new ATOM 0 HB3 ALA A 100 -13.824 5.485 0.404 1.00 0.00 H new ATOM 1606 N GLN A 101 -13.021 8.403 -0.547 1.00 0.00 N ATOM 1607 CA GLN A 101 -13.675 9.624 -1.002 1.00 0.00 C ATOM 1608 C GLN A 101 -12.677 10.557 -1.681 1.00 0.00 C ATOM 1609 O GLN A 101 -12.964 11.734 -1.900 1.00 0.00 O ATOM 1610 CB GLN A 101 -14.342 10.339 0.174 1.00 0.00 C ATOM 1611 CG GLN A 101 -15.713 9.783 0.526 1.00 0.00 C ATOM 1612 CD GLN A 101 -16.816 10.359 -0.339 1.00 0.00 C ATOM 1613 OE1 GLN A 101 -17.522 11.283 0.069 1.00 0.00 O ATOM 1614 NE2 GLN A 101 -16.971 9.817 -1.541 1.00 0.00 N ATOM 0 H GLN A 101 -12.723 8.422 0.428 1.00 0.00 H new ATOM 0 HA GLN A 101 -14.438 9.348 -1.730 1.00 0.00 H new ATOM 0 HB2 GLN A 101 -13.694 10.266 1.048 1.00 0.00 H new ATOM 0 HB3 GLN A 101 -14.439 11.398 -0.063 1.00 0.00 H new ATOM 0 HG2 GLN A 101 -15.700 8.699 0.417 1.00 0.00 H new ATOM 0 HG3 GLN A 101 -15.929 9.996 1.573 1.00 0.00 H new ATOM 0 HE21 GLN A 101 -16.364 9.053 -1.838 1.00 0.00 H new ATOM 0 HE22 GLN A 101 -17.697 10.164 -2.167 1.00 0.00 H new ATOM 1623 N CYS A 102 -11.506 10.023 -2.009 1.00 0.00 N ATOM 1624 CA CYS A 102 -10.464 10.809 -2.661 1.00 0.00 C ATOM 1625 C CYS A 102 -10.069 12.006 -1.803 1.00 0.00 C ATOM 1626 O CYS A 102 -9.846 13.103 -2.315 1.00 0.00 O ATOM 1627 CB CYS A 102 -10.940 11.285 -4.035 1.00 0.00 C ATOM 1628 SG CYS A 102 -9.656 12.085 -5.025 1.00 0.00 S ATOM 0 H CYS A 102 -11.254 9.050 -1.835 1.00 0.00 H new ATOM 0 HA CYS A 102 -9.589 10.172 -2.788 1.00 0.00 H new ATOM 0 HB2 CYS A 102 -11.331 10.431 -4.588 1.00 0.00 H new ATOM 0 HB3 CYS A 102 -11.767 11.982 -3.900 1.00 0.00 H new ATOM 0 HG CYS A 102 -8.984 12.911 -4.279 1.00 0.00 H new ATOM 1634 N ALA A 103 -9.985 11.788 -0.495 1.00 0.00 N ATOM 1635 CA ALA A 103 -9.616 12.849 0.434 1.00 0.00 C ATOM 1636 C ALA A 103 -8.112 13.101 0.410 1.00 0.00 C ATOM 1637 O ALA A 103 -7.306 12.225 0.726 1.00 0.00 O ATOM 1638 CB ALA A 103 -10.072 12.499 1.843 1.00 0.00 C ATOM 0 H ALA A 103 -10.167 10.886 -0.055 1.00 0.00 H new ATOM 0 HA ALA A 103 -10.117 13.765 0.119 1.00 0.00 H new ATOM 0 HB1 ALA A 103 -9.790 13.300 2.526 1.00 0.00 H new ATOM 0 HB2 ALA A 103 -11.155 12.376 1.855 1.00 0.00 H new ATOM 0 HB3 ALA A 103 -9.598 11.569 2.158 1.00 0.00 H new ATOM 1644 N PRO A 104 -7.723 14.326 0.027 1.00 0.00 N ATOM 1645 CA PRO A 104 -6.313 14.721 -0.048 1.00 0.00 C ATOM 1646 C PRO A 104 -5.671 14.842 1.330 1.00 0.00 C ATOM 1647 O PRO A 104 -6.102 15.643 2.158 1.00 0.00 O ATOM 1648 CB PRO A 104 -6.364 16.088 -0.735 1.00 0.00 C ATOM 1649 CG PRO A 104 -7.722 16.617 -0.427 1.00 0.00 C ATOM 1650 CD PRO A 104 -8.628 15.419 -0.364 1.00 0.00 C ATOM 0 HA PRO A 104 -5.711 13.984 -0.579 1.00 0.00 H new ATOM 0 HB2 PRO A 104 -5.586 16.751 -0.356 1.00 0.00 H new ATOM 0 HB3 PRO A 104 -6.209 15.997 -1.810 1.00 0.00 H new ATOM 0 HG2 PRO A 104 -7.725 17.159 0.519 1.00 0.00 H new ATOM 0 HG3 PRO A 104 -8.052 17.316 -1.195 1.00 0.00 H new ATOM 0 HD2 PRO A 104 -9.428 15.558 0.364 1.00 0.00 H new ATOM 0 HD3 PRO A 104 -9.102 15.223 -1.326 1.00 0.00 H new ATOM 1658 N GLY A 105 -4.638 14.039 1.570 1.00 0.00 N ATOM 1659 CA GLY A 105 -3.954 14.073 2.849 1.00 0.00 C ATOM 1660 C GLY A 105 -4.284 12.873 3.714 1.00 0.00 C ATOM 1661 O GLY A 105 -3.388 12.182 4.200 1.00 0.00 O ATOM 0 H GLY A 105 -4.263 13.366 0.901 1.00 0.00 H new ATOM 0 HA2 GLY A 105 -2.878 14.111 2.681 1.00 0.00 H new ATOM 0 HA3 GLY A 105 -4.227 14.985 3.379 1.00 0.00 H new ATOM 1665 N VAL A 106 -5.575 12.624 3.911 1.00 0.00 N ATOM 1666 CA VAL A 106 -6.022 11.499 4.724 1.00 0.00 C ATOM 1667 C VAL A 106 -5.225 10.239 4.405 1.00 0.00 C ATOM 1668 O VAL A 106 -4.528 9.698 5.263 1.00 0.00 O ATOM 1669 CB VAL A 106 -7.520 11.214 4.513 1.00 0.00 C ATOM 1670 CG1 VAL A 106 -7.973 10.056 5.390 1.00 0.00 C ATOM 1671 CG2 VAL A 106 -8.345 12.461 4.794 1.00 0.00 C ATOM 0 H VAL A 106 -6.330 13.187 3.518 1.00 0.00 H new ATOM 0 HA VAL A 106 -5.856 11.776 5.765 1.00 0.00 H new ATOM 0 HB VAL A 106 -7.674 10.931 3.472 1.00 0.00 H new ATOM 0 HG11 VAL A 106 -9.034 9.870 5.227 1.00 0.00 H new ATOM 0 HG12 VAL A 106 -7.404 9.162 5.135 1.00 0.00 H new ATOM 0 HG13 VAL A 106 -7.805 10.306 6.438 1.00 0.00 H new ATOM 0 HG21 VAL A 106 -9.401 12.241 4.640 1.00 0.00 H new ATOM 0 HG22 VAL A 106 -8.187 12.777 5.825 1.00 0.00 H new ATOM 0 HG23 VAL A 106 -8.039 13.260 4.119 1.00 0.00 H new ATOM 1681 N VAL A 107 -5.333 9.777 3.164 1.00 0.00 N ATOM 1682 CA VAL A 107 -4.621 8.580 2.729 1.00 0.00 C ATOM 1683 C VAL A 107 -3.169 8.607 3.191 1.00 0.00 C ATOM 1684 O VAL A 107 -2.612 7.581 3.580 1.00 0.00 O ATOM 1685 CB VAL A 107 -4.659 8.430 1.197 1.00 0.00 C ATOM 1686 CG1 VAL A 107 -4.015 9.634 0.526 1.00 0.00 C ATOM 1687 CG2 VAL A 107 -3.973 7.141 0.771 1.00 0.00 C ATOM 0 H VAL A 107 -5.906 10.213 2.442 1.00 0.00 H new ATOM 0 HA VAL A 107 -5.127 7.728 3.182 1.00 0.00 H new ATOM 0 HB VAL A 107 -5.701 8.382 0.880 1.00 0.00 H new ATOM 0 HG11 VAL A 107 -4.051 9.510 -0.556 1.00 0.00 H new ATOM 0 HG12 VAL A 107 -4.555 10.539 0.806 1.00 0.00 H new ATOM 0 HG13 VAL A 107 -2.977 9.717 0.847 1.00 0.00 H new ATOM 0 HG21 VAL A 107 -4.009 7.051 -0.315 1.00 0.00 H new ATOM 0 HG22 VAL A 107 -2.934 7.156 1.099 1.00 0.00 H new ATOM 0 HG23 VAL A 107 -4.484 6.291 1.223 1.00 0.00 H new ATOM 1697 N GLU A 108 -2.560 9.788 3.144 1.00 0.00 N ATOM 1698 CA GLU A 108 -1.171 9.948 3.557 1.00 0.00 C ATOM 1699 C GLU A 108 -1.009 9.651 5.045 1.00 0.00 C ATOM 1700 O GLU A 108 0.006 9.098 5.473 1.00 0.00 O ATOM 1701 CB GLU A 108 -0.685 11.366 3.253 1.00 0.00 C ATOM 1702 CG GLU A 108 -0.966 11.813 1.828 1.00 0.00 C ATOM 1703 CD GLU A 108 0.092 11.342 0.849 1.00 0.00 C ATOM 1704 OE1 GLU A 108 1.134 12.019 0.729 1.00 0.00 O ATOM 1705 OE2 GLU A 108 -0.123 10.294 0.204 1.00 0.00 O ATOM 0 H GLU A 108 -3.007 10.647 2.824 1.00 0.00 H new ATOM 0 HA GLU A 108 -0.567 9.237 2.994 1.00 0.00 H new ATOM 0 HB2 GLU A 108 -1.163 12.061 3.944 1.00 0.00 H new ATOM 0 HB3 GLU A 108 0.388 11.421 3.437 1.00 0.00 H new ATOM 0 HG2 GLU A 108 -1.939 11.432 1.517 1.00 0.00 H new ATOM 0 HG3 GLU A 108 -1.025 12.901 1.798 1.00 0.00 H new ATOM 1712 N LEU A 109 -2.014 10.023 5.830 1.00 0.00 N ATOM 1713 CA LEU A 109 -1.984 9.798 7.271 1.00 0.00 C ATOM 1714 C LEU A 109 -1.708 8.332 7.587 1.00 0.00 C ATOM 1715 O LEU A 109 -1.289 7.993 8.694 1.00 0.00 O ATOM 1716 CB LEU A 109 -3.310 10.228 7.902 1.00 0.00 C ATOM 1717 CG LEU A 109 -3.682 11.702 7.743 1.00 0.00 C ATOM 1718 CD1 LEU A 109 -5.013 11.992 8.419 1.00 0.00 C ATOM 1719 CD2 LEU A 109 -2.587 12.593 8.314 1.00 0.00 C ATOM 0 H LEU A 109 -2.860 10.482 5.493 1.00 0.00 H new ATOM 0 HA LEU A 109 -1.178 10.399 7.691 1.00 0.00 H new ATOM 0 HB2 LEU A 109 -4.108 9.624 7.470 1.00 0.00 H new ATOM 0 HB3 LEU A 109 -3.275 9.996 8.966 1.00 0.00 H new ATOM 0 HG LEU A 109 -3.782 11.919 6.680 1.00 0.00 H new ATOM 0 HD11 LEU A 109 -5.262 13.046 8.296 1.00 0.00 H new ATOM 0 HD12 LEU A 109 -5.792 11.380 7.965 1.00 0.00 H new ATOM 0 HD13 LEU A 109 -4.940 11.758 9.481 1.00 0.00 H new ATOM 0 HD21 LEU A 109 -2.869 13.639 8.192 1.00 0.00 H new ATOM 0 HD22 LEU A 109 -2.455 12.374 9.374 1.00 0.00 H new ATOM 0 HD23 LEU A 109 -1.652 12.405 7.785 1.00 0.00 H new ATOM 1731 N VAL A 110 -1.945 7.466 6.607 1.00 0.00 N ATOM 1732 CA VAL A 110 -1.719 6.036 6.779 1.00 0.00 C ATOM 1733 C VAL A 110 -0.469 5.583 6.034 1.00 0.00 C ATOM 1734 O VAL A 110 0.154 4.582 6.393 1.00 0.00 O ATOM 1735 CB VAL A 110 -2.924 5.214 6.285 1.00 0.00 C ATOM 1736 CG1 VAL A 110 -2.610 3.726 6.331 1.00 0.00 C ATOM 1737 CG2 VAL A 110 -4.160 5.532 7.113 1.00 0.00 C ATOM 0 H VAL A 110 -2.294 7.730 5.685 1.00 0.00 H new ATOM 0 HA VAL A 110 -1.584 5.863 7.847 1.00 0.00 H new ATOM 0 HB VAL A 110 -3.128 5.486 5.249 1.00 0.00 H new ATOM 0 HG11 VAL A 110 -3.473 3.161 5.978 1.00 0.00 H new ATOM 0 HG12 VAL A 110 -1.752 3.515 5.692 1.00 0.00 H new ATOM 0 HG13 VAL A 110 -2.379 3.434 7.356 1.00 0.00 H new ATOM 0 HG21 VAL A 110 -5.002 4.943 6.751 1.00 0.00 H new ATOM 0 HG22 VAL A 110 -3.970 5.289 8.158 1.00 0.00 H new ATOM 0 HG23 VAL A 110 -4.395 6.593 7.024 1.00 0.00 H new ATOM 1747 N LEU A 111 -0.106 6.325 4.994 1.00 0.00 N ATOM 1748 CA LEU A 111 1.072 6.001 4.196 1.00 0.00 C ATOM 1749 C LEU A 111 2.353 6.306 4.966 1.00 0.00 C ATOM 1750 O LEU A 111 3.323 5.550 4.901 1.00 0.00 O ATOM 1751 CB LEU A 111 1.054 6.785 2.882 1.00 0.00 C ATOM 1752 CG LEU A 111 -0.067 6.432 1.905 1.00 0.00 C ATOM 1753 CD1 LEU A 111 -0.168 7.480 0.807 1.00 0.00 C ATOM 1754 CD2 LEU A 111 0.163 5.051 1.307 1.00 0.00 C ATOM 0 H LEU A 111 -0.610 7.155 4.683 1.00 0.00 H new ATOM 0 HA LEU A 111 1.048 4.934 3.976 1.00 0.00 H new ATOM 0 HB2 LEU A 111 0.983 7.847 3.117 1.00 0.00 H new ATOM 0 HB3 LEU A 111 2.009 6.633 2.378 1.00 0.00 H new ATOM 0 HG LEU A 111 -1.009 6.417 2.453 1.00 0.00 H new ATOM 0 HD11 LEU A 111 -0.971 7.212 0.121 1.00 0.00 H new ATOM 0 HD12 LEU A 111 -0.379 8.453 1.251 1.00 0.00 H new ATOM 0 HD13 LEU A 111 0.774 7.527 0.261 1.00 0.00 H new ATOM 0 HD21 LEU A 111 -0.644 4.816 0.614 1.00 0.00 H new ATOM 0 HD22 LEU A 111 1.114 5.039 0.774 1.00 0.00 H new ATOM 0 HD23 LEU A 111 0.185 4.308 2.104 1.00 0.00 H new ATOM 1766 N ILE A 112 2.347 7.416 5.697 1.00 0.00 N ATOM 1767 CA ILE A 112 3.507 7.818 6.482 1.00 0.00 C ATOM 1768 C ILE A 112 3.936 6.709 7.437 1.00 0.00 C ATOM 1769 O ILE A 112 5.070 6.230 7.402 1.00 0.00 O ATOM 1770 CB ILE A 112 3.222 9.096 7.293 1.00 0.00 C ATOM 1771 CG1 ILE A 112 3.592 10.337 6.477 1.00 0.00 C ATOM 1772 CG2 ILE A 112 3.989 9.072 8.607 1.00 0.00 C ATOM 1773 CD1 ILE A 112 3.019 11.620 7.037 1.00 0.00 C ATOM 0 H ILE A 112 1.552 8.052 5.762 1.00 0.00 H new ATOM 0 HA ILE A 112 4.312 8.017 5.775 1.00 0.00 H new ATOM 0 HB ILE A 112 2.156 9.136 7.518 1.00 0.00 H new ATOM 0 HG12 ILE A 112 4.678 10.422 6.432 1.00 0.00 H new ATOM 0 HG13 ILE A 112 3.240 10.207 5.454 1.00 0.00 H new ATOM 0 HG21 ILE A 112 3.777 9.982 9.169 1.00 0.00 H new ATOM 0 HG22 ILE A 112 3.682 8.205 9.192 1.00 0.00 H new ATOM 0 HG23 ILE A 112 5.058 9.012 8.403 1.00 0.00 H new ATOM 0 HD11 ILE A 112 3.321 12.458 6.409 1.00 0.00 H new ATOM 0 HD12 ILE A 112 1.931 11.555 7.056 1.00 0.00 H new ATOM 0 HD13 ILE A 112 3.391 11.773 8.050 1.00 0.00 H new ATOM 1785 N PRO A 113 3.009 6.289 8.310 1.00 0.00 N ATOM 1786 CA PRO A 113 3.267 5.229 9.290 1.00 0.00 C ATOM 1787 C PRO A 113 3.414 3.859 8.637 1.00 0.00 C ATOM 1788 O PRO A 113 4.216 3.033 9.076 1.00 0.00 O ATOM 1789 CB PRO A 113 2.026 5.264 10.185 1.00 0.00 C ATOM 1790 CG PRO A 113 0.954 5.838 9.325 1.00 0.00 C ATOM 1791 CD PRO A 113 1.637 6.815 8.409 1.00 0.00 C ATOM 0 HA PRO A 113 4.202 5.389 9.827 1.00 0.00 H new ATOM 0 HB2 PRO A 113 1.761 4.266 10.534 1.00 0.00 H new ATOM 0 HB3 PRO A 113 2.194 5.877 11.070 1.00 0.00 H new ATOM 0 HG2 PRO A 113 0.450 5.057 8.756 1.00 0.00 H new ATOM 0 HG3 PRO A 113 0.194 6.334 9.928 1.00 0.00 H new ATOM 0 HD2 PRO A 113 1.152 6.858 7.434 1.00 0.00 H new ATOM 0 HD3 PRO A 113 1.623 7.826 8.817 1.00 0.00 H new ATOM 1799 N LEU A 114 2.637 3.623 7.586 1.00 0.00 N ATOM 1800 CA LEU A 114 2.681 2.353 6.871 1.00 0.00 C ATOM 1801 C LEU A 114 4.085 2.072 6.344 1.00 0.00 C ATOM 1802 O LEU A 114 4.678 1.037 6.649 1.00 0.00 O ATOM 1803 CB LEU A 114 1.682 2.361 5.713 1.00 0.00 C ATOM 1804 CG LEU A 114 1.681 1.122 4.817 1.00 0.00 C ATOM 1805 CD1 LEU A 114 0.271 0.807 4.342 1.00 0.00 C ATOM 1806 CD2 LEU A 114 2.614 1.320 3.631 1.00 0.00 C ATOM 0 H LEU A 114 1.968 4.295 7.210 1.00 0.00 H new ATOM 0 HA LEU A 114 2.410 1.562 7.571 1.00 0.00 H new ATOM 0 HB2 LEU A 114 0.681 2.488 6.125 1.00 0.00 H new ATOM 0 HB3 LEU A 114 1.884 3.234 5.092 1.00 0.00 H new ATOM 0 HG LEU A 114 2.043 0.276 5.401 1.00 0.00 H new ATOM 0 HD11 LEU A 114 0.291 -0.078 3.706 1.00 0.00 H new ATOM 0 HD12 LEU A 114 -0.370 0.620 5.204 1.00 0.00 H new ATOM 0 HD13 LEU A 114 -0.120 1.653 3.776 1.00 0.00 H new ATOM 0 HD21 LEU A 114 2.600 0.428 3.004 1.00 0.00 H new ATOM 0 HD22 LEU A 114 2.283 2.179 3.047 1.00 0.00 H new ATOM 0 HD23 LEU A 114 3.628 1.495 3.991 1.00 0.00 H new ATOM 1818 N ARG A 115 4.611 3.002 5.554 1.00 0.00 N ATOM 1819 CA ARG A 115 5.946 2.856 4.986 1.00 0.00 C ATOM 1820 C ARG A 115 6.974 2.577 6.079 1.00 0.00 C ATOM 1821 O ARG A 115 7.876 1.759 5.900 1.00 0.00 O ATOM 1822 CB ARG A 115 6.336 4.118 4.214 1.00 0.00 C ATOM 1823 CG ARG A 115 7.797 4.148 3.794 1.00 0.00 C ATOM 1824 CD ARG A 115 8.291 5.573 3.598 1.00 0.00 C ATOM 1825 NE ARG A 115 9.749 5.655 3.629 1.00 0.00 N ATOM 1826 CZ ARG A 115 10.416 6.759 3.946 1.00 0.00 C ATOM 1827 NH1 ARG A 115 9.759 7.868 4.258 1.00 0.00 N ATOM 1828 NH2 ARG A 115 11.743 6.756 3.951 1.00 0.00 N ATOM 0 H ARG A 115 4.133 3.865 5.293 1.00 0.00 H new ATOM 0 HA ARG A 115 5.931 2.009 4.300 1.00 0.00 H new ATOM 0 HB2 ARG A 115 5.710 4.198 3.326 1.00 0.00 H new ATOM 0 HB3 ARG A 115 6.126 4.991 4.832 1.00 0.00 H new ATOM 0 HG2 ARG A 115 8.405 3.652 4.551 1.00 0.00 H new ATOM 0 HG3 ARG A 115 7.922 3.588 2.867 1.00 0.00 H new ATOM 0 HD2 ARG A 115 7.926 5.955 2.645 1.00 0.00 H new ATOM 0 HD3 ARG A 115 7.875 6.211 4.377 1.00 0.00 H new ATOM 0 HE ARG A 115 10.284 4.819 3.394 1.00 0.00 H new ATOM 0 HH11 ARG A 115 8.739 7.874 4.255 1.00 0.00 H new ATOM 0 HH12 ARG A 115 10.274 8.714 4.501 1.00 0.00 H new ATOM 0 HH21 ARG A 115 12.252 5.905 3.711 1.00 0.00 H new ATOM 0 HH22 ARG A 115 12.254 7.604 4.195 1.00 0.00 H new ATOM 1842 N GLN A 116 6.831 3.263 7.208 1.00 0.00 N ATOM 1843 CA GLN A 116 7.748 3.089 8.328 1.00 0.00 C ATOM 1844 C GLN A 116 7.865 1.618 8.713 1.00 0.00 C ATOM 1845 O GLN A 116 8.961 1.058 8.741 1.00 0.00 O ATOM 1846 CB GLN A 116 7.278 3.908 9.532 1.00 0.00 C ATOM 1847 CG GLN A 116 7.813 5.330 9.547 1.00 0.00 C ATOM 1848 CD GLN A 116 9.242 5.411 10.046 1.00 0.00 C ATOM 1849 OE1 GLN A 116 10.160 4.873 9.426 1.00 0.00 O ATOM 1850 NE2 GLN A 116 9.438 6.085 11.174 1.00 0.00 N ATOM 0 H GLN A 116 6.089 3.944 7.371 1.00 0.00 H new ATOM 0 HA GLN A 116 8.731 3.444 8.018 1.00 0.00 H new ATOM 0 HB2 GLN A 116 6.188 3.939 9.537 1.00 0.00 H new ATOM 0 HB3 GLN A 116 7.587 3.403 10.447 1.00 0.00 H new ATOM 0 HG2 GLN A 116 7.760 5.745 8.540 1.00 0.00 H new ATOM 0 HG3 GLN A 116 7.176 5.947 10.180 1.00 0.00 H new ATOM 0 HE21 GLN A 116 8.648 6.515 11.655 1.00 0.00 H new ATOM 0 HE22 GLN A 116 10.378 6.172 11.559 1.00 0.00 H new ATOM 1859 N ARG A 117 6.728 0.997 9.010 1.00 0.00 N ATOM 1860 CA ARG A 117 6.703 -0.409 9.395 1.00 0.00 C ATOM 1861 C ARG A 117 7.435 -1.267 8.367 1.00 0.00 C ATOM 1862 O ARG A 117 8.335 -2.034 8.711 1.00 0.00 O ATOM 1863 CB ARG A 117 5.260 -0.893 9.545 1.00 0.00 C ATOM 1864 CG ARG A 117 4.689 -0.686 10.939 1.00 0.00 C ATOM 1865 CD ARG A 117 4.990 0.710 11.462 1.00 0.00 C ATOM 1866 NE ARG A 117 4.261 1.001 12.693 1.00 0.00 N ATOM 1867 CZ ARG A 117 4.420 2.118 13.395 1.00 0.00 C ATOM 1868 NH1 ARG A 117 5.278 3.044 12.988 1.00 0.00 N ATOM 1869 NH2 ARG A 117 3.720 2.311 14.505 1.00 0.00 N ATOM 0 H ARG A 117 5.812 1.445 8.991 1.00 0.00 H new ATOM 0 HA ARG A 117 7.213 -0.507 10.353 1.00 0.00 H new ATOM 0 HB2 ARG A 117 4.633 -0.369 8.823 1.00 0.00 H new ATOM 0 HB3 ARG A 117 5.214 -1.953 9.297 1.00 0.00 H new ATOM 0 HG2 ARG A 117 3.611 -0.844 10.919 1.00 0.00 H new ATOM 0 HG3 ARG A 117 5.107 -1.429 11.619 1.00 0.00 H new ATOM 0 HD2 ARG A 117 6.061 0.806 11.643 1.00 0.00 H new ATOM 0 HD3 ARG A 117 4.728 1.446 10.702 1.00 0.00 H new ATOM 0 HE ARG A 117 3.593 0.309 13.033 1.00 0.00 H new ATOM 0 HH11 ARG A 117 5.817 2.900 12.134 1.00 0.00 H new ATOM 0 HH12 ARG A 117 5.398 3.901 13.529 1.00 0.00 H new ATOM 0 HH21 ARG A 117 3.059 1.602 14.821 1.00 0.00 H new ATOM 0 HH22 ARG A 117 3.843 3.169 15.043 1.00 0.00 H new ATOM 1883 N LEU A 118 7.041 -1.133 7.105 1.00 0.00 N ATOM 1884 CA LEU A 118 7.659 -1.897 6.026 1.00 0.00 C ATOM 1885 C LEU A 118 9.157 -2.062 6.265 1.00 0.00 C ATOM 1886 O LEU A 118 9.666 -3.181 6.319 1.00 0.00 O ATOM 1887 CB LEU A 118 7.418 -1.205 4.683 1.00 0.00 C ATOM 1888 CG LEU A 118 6.057 -1.456 4.034 1.00 0.00 C ATOM 1889 CD1 LEU A 118 5.836 -0.502 2.871 1.00 0.00 C ATOM 1890 CD2 LEU A 118 5.945 -2.901 3.569 1.00 0.00 C ATOM 0 H LEU A 118 6.297 -0.503 6.804 1.00 0.00 H new ATOM 0 HA LEU A 118 7.202 -2.886 6.005 1.00 0.00 H new ATOM 0 HB2 LEU A 118 7.539 -0.131 4.824 1.00 0.00 H new ATOM 0 HB3 LEU A 118 8.194 -1.525 3.988 1.00 0.00 H new ATOM 0 HG LEU A 118 5.282 -1.274 4.779 1.00 0.00 H new ATOM 0 HD11 LEU A 118 4.862 -0.696 2.422 1.00 0.00 H new ATOM 0 HD12 LEU A 118 5.871 0.526 3.232 1.00 0.00 H new ATOM 0 HD13 LEU A 118 6.616 -0.651 2.125 1.00 0.00 H new ATOM 0 HD21 LEU A 118 4.970 -3.061 3.110 1.00 0.00 H new ATOM 0 HD22 LEU A 118 6.728 -3.110 2.840 1.00 0.00 H new ATOM 0 HD23 LEU A 118 6.057 -3.568 4.424 1.00 0.00 H new ATOM 1902 N GLU A 119 9.856 -0.941 6.409 1.00 0.00 N ATOM 1903 CA GLU A 119 11.295 -0.963 6.643 1.00 0.00 C ATOM 1904 C GLU A 119 11.657 -1.999 7.703 1.00 0.00 C ATOM 1905 O GLU A 119 12.652 -2.712 7.573 1.00 0.00 O ATOM 1906 CB GLU A 119 11.784 0.420 7.077 1.00 0.00 C ATOM 1907 CG GLU A 119 11.855 1.425 5.940 1.00 0.00 C ATOM 1908 CD GLU A 119 13.135 1.307 5.136 1.00 0.00 C ATOM 1909 OE1 GLU A 119 13.170 0.492 4.191 1.00 0.00 O ATOM 1910 OE2 GLU A 119 14.102 2.032 5.452 1.00 0.00 O ATOM 0 H GLU A 119 9.449 -0.006 6.368 1.00 0.00 H new ATOM 0 HA GLU A 119 11.786 -1.237 5.709 1.00 0.00 H new ATOM 0 HB2 GLU A 119 11.119 0.805 7.850 1.00 0.00 H new ATOM 0 HB3 GLU A 119 12.772 0.322 7.526 1.00 0.00 H new ATOM 0 HG2 GLU A 119 11.001 1.281 5.279 1.00 0.00 H new ATOM 0 HG3 GLU A 119 11.777 2.434 6.346 1.00 0.00 H new ATOM 1917 N GLU A 120 10.844 -2.074 8.752 1.00 0.00 N ATOM 1918 CA GLU A 120 11.080 -3.021 9.835 1.00 0.00 C ATOM 1919 C GLU A 120 11.175 -4.447 9.299 1.00 0.00 C ATOM 1920 O GLU A 120 12.113 -5.179 9.616 1.00 0.00 O ATOM 1921 CB GLU A 120 9.962 -2.929 10.876 1.00 0.00 C ATOM 1922 CG GLU A 120 10.241 -3.724 12.140 1.00 0.00 C ATOM 1923 CD GLU A 120 9.860 -5.186 12.007 1.00 0.00 C ATOM 1924 OE1 GLU A 120 8.716 -5.464 11.592 1.00 0.00 O ATOM 1925 OE2 GLU A 120 10.706 -6.050 12.317 1.00 0.00 O ATOM 0 H GLU A 120 10.016 -1.490 8.875 1.00 0.00 H new ATOM 0 HA GLU A 120 12.028 -2.765 10.308 1.00 0.00 H new ATOM 0 HB2 GLU A 120 9.809 -1.883 11.141 1.00 0.00 H new ATOM 0 HB3 GLU A 120 9.033 -3.284 10.431 1.00 0.00 H new ATOM 0 HG2 GLU A 120 11.301 -3.650 12.385 1.00 0.00 H new ATOM 0 HG3 GLU A 120 9.690 -3.283 12.971 1.00 0.00 H new ATOM 1932 N ARG A 121 10.197 -4.834 8.487 1.00 0.00 N ATOM 1933 CA ARG A 121 10.169 -6.172 7.909 1.00 0.00 C ATOM 1934 C ARG A 121 11.302 -6.354 6.903 1.00 0.00 C ATOM 1935 O ARG A 121 11.894 -7.429 6.809 1.00 0.00 O ATOM 1936 CB ARG A 121 8.823 -6.429 7.229 1.00 0.00 C ATOM 1937 CG ARG A 121 7.762 -6.981 8.167 1.00 0.00 C ATOM 1938 CD ARG A 121 6.494 -7.356 7.415 1.00 0.00 C ATOM 1939 NE ARG A 121 5.519 -8.015 8.280 1.00 0.00 N ATOM 1940 CZ ARG A 121 5.565 -9.306 8.589 1.00 0.00 C ATOM 1941 NH1 ARG A 121 6.532 -10.073 8.106 1.00 0.00 N ATOM 1942 NH2 ARG A 121 4.641 -9.833 9.383 1.00 0.00 N ATOM 0 H ARG A 121 9.414 -4.240 8.215 1.00 0.00 H new ATOM 0 HA ARG A 121 10.304 -6.892 8.716 1.00 0.00 H new ATOM 0 HB2 ARG A 121 8.462 -5.497 6.794 1.00 0.00 H new ATOM 0 HB3 ARG A 121 8.969 -7.130 6.407 1.00 0.00 H new ATOM 0 HG2 ARG A 121 8.152 -7.858 8.684 1.00 0.00 H new ATOM 0 HG3 ARG A 121 7.528 -6.239 8.930 1.00 0.00 H new ATOM 0 HD2 ARG A 121 6.049 -6.459 6.985 1.00 0.00 H new ATOM 0 HD3 ARG A 121 6.747 -8.016 6.585 1.00 0.00 H new ATOM 0 HE ARG A 121 4.761 -7.453 8.668 1.00 0.00 H new ATOM 0 HH11 ARG A 121 7.244 -9.672 7.495 1.00 0.00 H new ATOM 0 HH12 ARG A 121 6.564 -11.064 8.345 1.00 0.00 H new ATOM 0 HH21 ARG A 121 3.895 -9.246 9.756 1.00 0.00 H new ATOM 0 HH22 ARG A 121 4.677 -10.825 9.620 1.00 0.00 H new ATOM 1956 N GLN A 122 11.596 -5.297 6.153 1.00 0.00 N ATOM 1957 CA GLN A 122 12.657 -5.341 5.154 1.00 0.00 C ATOM 1958 C GLN A 122 13.996 -5.687 5.796 1.00 0.00 C ATOM 1959 O GLN A 122 14.558 -6.753 5.546 1.00 0.00 O ATOM 1960 CB GLN A 122 12.758 -3.998 4.427 1.00 0.00 C ATOM 1961 CG GLN A 122 13.910 -3.928 3.438 1.00 0.00 C ATOM 1962 CD GLN A 122 15.237 -3.630 4.107 1.00 0.00 C ATOM 1963 OE1 GLN A 122 16.127 -4.479 4.152 1.00 0.00 O ATOM 1964 NE2 GLN A 122 15.377 -2.418 4.633 1.00 0.00 N ATOM 0 H GLN A 122 11.115 -4.400 6.218 1.00 0.00 H new ATOM 0 HA GLN A 122 12.410 -6.119 4.432 1.00 0.00 H new ATOM 0 HB2 GLN A 122 11.824 -3.809 3.898 1.00 0.00 H new ATOM 0 HB3 GLN A 122 12.873 -3.203 5.164 1.00 0.00 H new ATOM 0 HG2 GLN A 122 13.982 -4.875 2.903 1.00 0.00 H new ATOM 0 HG3 GLN A 122 13.700 -3.157 2.696 1.00 0.00 H new ATOM 0 HE21 GLN A 122 14.613 -1.745 4.573 1.00 0.00 H new ATOM 0 HE22 GLN A 122 16.248 -2.161 5.097 1.00 0.00 H new